Chem
J-GLOBAL ID：201607011887622679
Nikkaji number：J3.537.200H
(22Z)-2,7,12,17,22,27-Hexakis(pentafluorophenyl)-10,25,31,33,34,36-hexaazaheptacyclo[26.2.1.13,6.18,11.113,16.118,21.123,26]hexatriacontane-1,3(36),4,6,8(35),11,13,15,17,19,21(33),22,26(32),27,29-pentadecaene-9,24-dione
(22Z)-2,7,12,17,22,27-ヘキサキス(ペンタフルオロフェニル)-10,25,31,33,34,36-ヘキサアザヘプタシクロ[26.2.1.13,6.18,11.113,16.118,21.123,26]ヘキサトリアコンタン-1,3(36),4,6,8(35),11,13,15,17,19,21(33),22,26(32),27,29-ペンタデカエン-9,24-ジオン
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： C66H14F30N6O2
Molecular formula furigana： C66-H14-F30-N6-O2
Molecular weight： 1492.830
InChI：
InChI=1S/C66H14F30N6O2/c67-35-29(36(68)48(80)59(91)47(35)79)23-11-9-21(101-65(11)103)27(33-43(75)55(87)63(95)56(88)44(33)76)20-8-6-18(100-20)26(32-41(73)53(85)62(94)54(86)42(32)74)16-4-2-14(98-16)24(30-37(69)49(81)60(92)50(82)38(30)70)12-10-22(102-66(12)104)28(34-45(77)57(89)64(96)58(90)46(34)78)19-7-5-17(99-19)25(15-3-1-13(23)97-15)31-39(71)51(83)61(93)52(84)40(31)72/h1-10,99-100H,(H,101,103)(H,102,104)/b23-11-,23-13+,24-12+,24-14+,25-15+,25-17+,26-16+,26-18+,27-20+,27-21-,28-19+,28-22+
InChI key：
VOYCNEWVFSIXDH-DAGDKUDMSA-N
SMILES：
Fc1c(F)c(F)c(c(F)c1F)/C/1=c/2\cc/c(=C(/C3=C/C(=C(\C4=N/C(=C(\c5ccc(/C(=C\6/C=C(/C(=C\7/C=CC1=N7)/c1c(F)c(F)c(F)c(F)c1F)C(=O)N6)/c1c(F)c(F)c(F)c(F)c1F)[nH]5)/c1c(F)c(F)c(F)c(F)c1F)/C=C4)/c1c(F)c(F)c(F)c(F)c1F)/C(=O)N3)\c1c(F)c(F)c(F)c(F)c1F)/[nH]2
Systematic name (1)：
- (22Z)-2,7,12,17,22,27-ヘキサキス(ペンタフルオロフェニル)-10,25,31,33,34,36-ヘキサアザヘプタシクロ[26.2.1.13,6.18,11.113,16.118,21.123,26]ヘキサトリアコンタン-1,3(36),4,6,8(35),11,13,15,17,19,21(33),22,26(32),27,29-ペンタデカエン-9,24-ジオン
- (22Z)-2,7,12,17,22,27-Hexakis(pentafluorophenyl)-10,25,31,33,34,36-hexaazaheptacyclo[26.2.1.13,6.18,11.113,16.118,21.123,26]hexatriacontane-1,3(36),4,6,8(35),11,13,15,17,19,21(33),22,26(32),27,29-pentadecaene-9,24-dione
Return to Previous Page
