Chem
J-GLOBAL ID:200907006901919656
Nikkaji number:J1.205.938H
3,8,13-Tris[2-(trifluoromethyl)phenyl]-1,4:11,14-diepimino-6,9-epinitrilo-5,10,15-triazacyclopentadeca-1,3,5,7,10,12,14-heptene-2,7,12-tricarbonitrile
3,8,13-トリス[2-(トリフルオロメチル)フェニル]-1,4:11,14-ジエピミノ-6,9-エピニトリロ-5,10,15-トリアザシクロペンタデカ-1,3,5,7,10,12,14-ヘプタエン-2,7,12-トリカルボニトリル
Download MOL file
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:
C36 H14 F9 N9
Molecular formula furigana:
C36-H14-F9-N9
Molecular weight:
743.557
InChI:
InChI=1S/C36H14F9N9/c37-34(38,39)22-10-4-1-7-16(22)25-19(13-46)28-49-31(25)52-29-20(14-47)26(17-8-2-5-11-23(17)35(40,41)42)33(50-29)54-30-21(15-48)27(32(51-30)53-28)18-9-3-6-12-24(18)36(43,44)45/h1-12H,(H2,49,50,51,52,53,54)
InChI key:
IBYZPRFSNIOUAL-UHFFFAOYSA-N
SMILES:
FC(F)(F)c1ccccc1c1c(C#N)c2nc1nc1[nH]c(nc3[nH]c(n2)c(c3C#N)c2ccccc2C(F)(F)F)c(c1C#N)c1ccccc1C(F)(F)F
Systematic name (3):
3,8,13-トリス[2-(トリフルオロメチル)フェニル]-1,4:11,14-ジエピミノ-6,9-エピニトリロ-5,10,15-トリアザシクロペンタデカ-1,3,5,7,10,12,14-ヘプタエン-2,7,12-トリカルボニトリル
5,10,15-トリス[2-(トリフルオロメチル)フェニル]-2,7,12,16,17,18-ヘキサアザテトラシクロ[11.2.1.13,6 .18,11 ]オクタデカ-1,3,5,7,9,11(17),12,14-オクタエン-4,9,14-トリカルボニトリル
5,10,15-tris[2-(trifluoromethyl)phenyl]-2,7,12,16,17,18-hexaazatetracyclo[11.2.1.13,6 .18,11 ]octadeca-1,3,5,7,9,11(17),12,14-octaene-4,9,14-tricarbonitrile
Other name (1):
3,8,13-Tris[2-(trifluoromethyl)phenyl]-1,4:11,14-diepimino-6,9-epinitrilo-5,10,15-triazacyclopentadeca-1,3,5,7,10,12,14-heptene-2,7,12-tricarbonitrile
Thsaurus map:
Return to Previous Page