Chem
J-GLOBAL ID:200907027789708040   Nikkaji number:J1.810.243I

(1S)-1β-Methyl-4β-cyano-9-benzyl-1,2,3,4-tetrahydro-9H-carbazole-3β-carboxylic acid methyl ester

(1S)-1β-メチル-4β-シアノ-9-ベンジル-1,2,3,4-テトラヒドロ-9H-カルバゾール-3β-カルボン酸メチル
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: C23H22N2O2
Molecular formula furigana: C23-H22-N2-O2
Molecular weight: 358.441
InChI: InChI=1S/C23H22N2O2/c1-15-12-18(23(26)27-2)19(13-24)21-17-10-6-7-11-20(17)25(22(15)21)14-16-8-4-3-5-9-16/h3-11,15,18-19H,12,14H2,1-2H3/t15-,18+,19+/m0/s1
InChI key: DRIFSBYPUVERBB-KFKAGJAMSA-N
SMILES: COC(=O)[C@@H]1C[C@H](C)c2c([C@@H]1C#N)c1ccccc1n2Cc1ccccc1
Systematic name  (3):
  • (1S)-1β-メチル-4β-シアノ-9-ベンジル-1,2,3,4-テトラヒドロ-9H-カルバゾール-3β-カルボン酸メチル
  • メチル (1S,3R,4R)-9-ベンジル-4-シアノ-1-メチル-2,3,4,9-テトラヒドロ-1H-カルバゾール-3-カルボキシラート
  • methyl (1S,3R,4R)-9-benzyl-4-cyano-1-methyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate
Other name (1):
  • (1S)-1β-Methyl-4β-cyano-9-benzyl-1,2,3,4-tetrahydro-9H-carbazole-3β-carboxylic acid methyl ester
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