Chem
J-GLOBAL ID：200907007111937413
Nikkaji number：J2.490.952B
22,173,73,122-Tetrakis[13-(3,4-dicyanophenoxy)-7a,14c-dihydronaphtho[2,1-b]naphtho[1′,2′:4,5]furo[3,2-d]furan-2-yloxy]phthalocyanine
22,173,73,122-テトラキス[13-(3,4-ジシアノフェノキシ)-7a,14c-ジヒドロナフト[2,1-b]ナフト[1′,2′:4,5]フロ[3,2-d]フラン-2-イルオキシ]フタロシアニン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C152H74N16O16
Molecular formula furigana： C152-H74-N16-O16
Molecular weight： 2380.360
InChI：
InChI=1S/C152H74N16O16/c153-65-81-9-29-89(49-85(81)69-157)169-93-21-1-73-13-41-121-129(109(73)53-93)137-133-113-57-97(25-5-77(113)17-45-125(133)181-149(137)177-121)173-101-33-37-105-117(61-101)145-163-141(105)161-142-107-39-35-103(175-99-27-7-79-19-47-127-135(115(79)59-99)139-131-111-55-95(171-91-31-11-83(67-155)87(51-91)71-159)23-3-75(111)15-43-123(131)179-151(139)183-127)63-119(107)147(165-142)168-148-120-64-104(176-100-28-8-80-20-48-128-136(116(80)60-100)140-132-112-56-96(172-92-32-12-84(68-156)88(52-92)72-160)24-4-76(112)16-44-124(132)180-152(140)184-128)36-40-108(120)144(166-148)162-143-106-38-34-102(62-118(106)146(164-143)167-145)174-98-26-6-78-18-46-126-134(114(78)58-98)138-130-110-54-94(170-90-30-10-82(66-154)86(50-90)70-158)22-2-74(110)14-42-122(130)178-150(138)182-126/h1-64,137-140,149-152H,(H2,161,162,163,164,165,166,167,168)
InChI key：
ZVJGODSRVYMODG-UHFFFAOYSA-N
SMILES：
N#Cc1ccc(Oc2ccc3ccc4OC5Oc6ccc7ccc(Oc8ccc9/C/%10=N/c%11[nH]c(/N=C/%12\N=C(/N=c/%13\[nH]/c(=N\C(=N%10)c9c8)/c8c%13ccc(Oc9ccc%10ccc%13OC%14Oc%15ccc%16ccc(Oc%17ccc(C#N)c(c%17)C#N)cc%16c%15C%14c%13c%10c9)c8)c8c%12cc(Oc9ccc%10ccc%12OC%13Oc%14ccc%15ccc(Oc%16ccc(C#N)c(c%16)C#N)cc%15c%14C%13c%12c%10c9)cc8)c8c%11ccc(Oc9ccc%10ccc%11OC%12Oc%13ccc%14ccc(Oc%15ccc(C#N)c(c%15)C#N)cc%14c%13C%12c%11c%10c9)c8)cc7c6C5c4c3c2)cc1C#N
Systematic name (3)：
- 22,173,73,122-テトラキス[13-(3,4-ジシアノフェノキシ)-7a,14c-ジヒドロナフト[2,1-b]ナフト[1′,2′:4,5]フロ[3,2-d]フラン-2-イルオキシ]フタロシアニン
- 4-[(21-{[16,24,34-トリス({[21-(3,4-ジシアノフェノキシ)-12,14-ジオキサヘキサシクロ[11.11.0.02,11.03,8.015,24.018,23]テトラコサ-2(11),3,5,7,9,15,17,19,21,23-デカエン-5-イル]オキシ})-2,11,20,29,37,38,39,40-オクタアザノナシクロ[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]テトラコンタ-1,3(40),4,6,8,10,12,14,16,18,20,22,24,26,28(38),29,31,33,35-ノナデカエン-6-イル]オキシ}-12,14-ジオキサヘキサシクロ[11.11.0.02,11.03,8.015,24.018,23]テトラコサ-2(11),3,5,7,9,15,17,19,21,23-デカエン-5-イル)オキシ]ベンゼン-1,2-ジカルボニトリル
- 4-[(21-{[16,24,34-tris({[21-(3,4-dicyanophenoxy)-12,14-dioxahexacyclo[11.11.0.02,11.03,8.015,24.018,23]tetracosa-2(11),3,5,7,9,15,17,19,21,23-decaen-5-yl]oxy})-2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4,6,8,10,12,14,16,18,20,22,24,26,28(38),29,31,33,35-nonadecaen-6-yl]oxy}-12,14-dioxahexacyclo[11.11.0.02,11.03,8.015,24.018,23]tetracosa-2(11),3,5,7,9,15,17,19,21,23-decaen-5-yl)oxy]benzene-1,2-dicarbonitrile
- 22,173,73,122-Tetrakis[13-(3,4-dicyanophenoxy)-7a,14c-dihydronaphtho[2,1-b]naphtho[1′,2′:4,5]furo[3,2-d]furan-2-yloxy]phthalocyanine
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