Chem
J-GLOBAL ID：201407091175263468   Nikkaji number：J3.242.688C

(3aS,7aS)-1-(4-Methylbenzyl)-3-[(Z)-α-(4-methoxyphenyl)benzylidene]octahydro-1H-indole

(3aS,7aS)-1-(4-メチルベンジル)-3-[(Z)-α-(4-メトキシフェニル)ベンジリデン]オクタヒドロ-1H-インドール
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： C30H33NO
Molecular formula furigana： C30-H33-N-O
Molecular weight： 423.600
InChI： InChI=1S/C30H33NO/c1-22-12-14-23(15-13-22)20-31-21-28(27-10-6-7-11-29(27)31)30(24-8-4-3-5-9-24)25-16-18-26(32-2)19-17-25/h3-5,8-9,12-19,27,29H,6-7,10-11,20-21H2,1-2H3/b30-28+/t27-,29-/m0/s1
InChI key： UMKCBVUYOIVGMI-PMANDNIISA-N
SMILES： COc1ccc(cc1)/C(=C/1\CN(Cc2ccc(C)cc2)[C@H]2CCCC[C@@H]12)/c1ccccc1
Systematic name  (3)：
  • (3aS,7aS)-1-(4-メチルベンジル)-3-[(Z)-α-(4-メトキシフェニル)ベンジリデン]オクタヒドロ-1H-インドール
  • (3Z,3aS,7aS)-3-[(4-メトキシフェニル)(フェニル)メチリデン]-1-[(4-メチルフェニル)メチル]-オクタヒドロ-1H-インドール
  • (3Z,3aS,7aS)-3-[(4-methoxyphenyl)(phenyl)methylidene]-1-[(4-methylphenyl)methyl]-octahydro-1H-indole
Other name (1)：
  • (3aS,7aS)-1-(4-Methylbenzyl)-3-[(Z)-α-(4-methoxyphenyl)benzylidene]octahydro-1H-indole
Thsaurus map：
Thesaurus Map

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