Chem
J-GLOBAL ID：201807016495445252   Nikkaji number：J3.730.764E

3,9-ビス(4-メチルフェニル)-2,10,12-トリアザテトラシクロ[6.6.2.04,16.011,15]ヘキサデカ-2,4(16),5,7,9,11,13-ヘプタエン

3,9-ビス(4-メチルフェニル)-2,10,12-トリアザテトラシクロ[6.6.2.04,16.011,15]ヘキサデカ-2,4(16),5,7,9,11,13-ヘプタエン
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： C27H21N3
Molecular formula furigana： C27-H21-N3
Molecular weight： 387.486
InChI： InChI=1S/C27H21N3/c1-16-6-10-18(11-7-16)25-20-4-3-5-21-23(20)24-22(29-25)14-15-28-27(24)30-26(21)19-12-8-17(2)9-13-19/h3-15,22,24H,1-2H3
InChI key： MJAXPRQSSSYPOL-UHFFFAOYSA-N
SMILES： C12=NC=CC3C2c2c(C(=N1)c1ccc(C)cc1)cccc2C(=N3)c1ccc(C)cc1
Systematic name  (2)：
  • 3,9-ビス(4-メチルフェニル)-2,10,12-トリアザテトラシクロ[6.6.2.04,16.011,15]ヘキサデカ-2,4(16),5,7,9,11,13-ヘプタエン
  • 3,9-bis(4-methylphenyl)-2,10,12-triazatetracyclo[6.6.2.04,16.011,15]hexadeca-2,4(16),5,7,9,11,13-heptaene
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