Chem
J-GLOBAL ID：200907008740529600   Nikkaji number：J2.145.954B

2-[[4-(10,15,20-Triphenyl-21H,23H-porphyrin-5-yl)phenoxy]methyl]-6-butylbenzo[1,2-c:4,5-c′]dipyrrole-1,3,5,7(2H,6H)-tetrone

2-[[4-(10,15,20-トリフェニル-21H,23H-ポルフィリン-5-イル)フェノキシ]メチル]-6-ブチルベンゾ[1,2-c:4,5-c′]ジピロール-1,3,5,7(2H,6H)-テトラオン
Substance type：
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
Molecular formula： C59H42N6O5
Molecular formula furigana： C59-H42-N6-O5
Molecular weight： 915.022
InChI： InChI=1S/C59H42N6O5/c1-2-3-31-64-56(66)40-32-42-43(33-41(40)57(64)67)59(69)65(58(42)68)34-70-39-21-19-38(20-22-39)55-50-29-27-48(62-50)53(36-15-9-5-10-16-36)46-25-23-44(60-46)52(35-13-7-4-8-14-35)45-24-26-47(61-45)54(37-17-11-6-12-18-37)49-28-30-51(55)63-49/h4-30,32-33,60,63H,2-3,31,34H2,1H3/b52-44-,52-45-,53-46-,53-48-,54-47-,54-49-,55-50-,55-51-
InChI key： NLEFQXQLYAIUGW-DHSWGDOPSA-N
SMILES： CCCCn1c(=O)c2cc3c(cc2c1=O)c(=O)n(COc1ccc(cc1)/C/1=c/2\cc/c(=C(/C4=N/C(=C(\c5ccc(/C(=C\6/C=CC1=N6)/c1ccccc1)[nH]5)/c1ccccc1)/C=C4)\c1ccccc1)/[nH]2)c3=O
Systematic name  (3)：
  • 2-[[4-(10,15,20-トリフェニル-21H,23H-ポルフィリン-5-イル)フェノキシ]メチル]-6-ブチルベンゾ[1,2-c:4,5-c′]ジピロール-1,3,5,7(2H,6H)-テトラオン
  • 2-ブチル-6-[(4-{7,12,17-トリフェニル-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3(24),4,6,8,10,12,14,16(22),17,19-ウンデカエン-2-イル}フェノキシ)メチル]-1H,2H,3H,5H,6H,7H-ピロロ[3,4-f]イソインドール-1,3,5,7-テトラオン
  • 2-butyl-6-[(4-{7,12,17-triphenyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl}phenoxy)methyl]-1H,2H,3H,5H,6H,7H-pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
Other name (1)：
  • 2-[[4-(10,15,20-Triphenyl-21H,23H-porphyrin-5-yl)phenoxy]methyl]-6-butylbenzo[1,2-c:4,5-c′]dipyrrole-1,3,5,7(2H,6H)-tetrone
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