Chem
J-GLOBAL ID：201507076568905869   Nikkaji number：J3.394.589B

2-(4-Chlorophenyl)-3β-cyano-1,8b-(iminoethano)-3,3a,4,8b-tetrahydrocyclopenta[b]indole-3α-carboxylic acid methyl ester

2-(4-クロロフェニル)-3β-シアノ-1,8b-(イミノエタノ)-3,3a,4,8b-テトラヒドロシクロペンタ[b]インドール-3α-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： C22H18ClN3O2
Molecular formula furigana： C22-H18-CL-N3-O2
Molecular weight： 391.860
InChI： InChI=1S/C22H18ClN3O2/c1-28-20(27)22(12-24)17(13-6-8-14(23)9-7-13)18-21(10-11-25-18)15-4-2-3-5-16(15)26-19(21)22/h2-9,19,25-26H,10-11H2,1H3/t19?,21?,22-/m0/s1
InChI key： NDHQXJQTXOWMJX-VTLFHKLASA-N
SMILES： COC(=O)[C@]1(C#N)C2Nc3ccccc3C32CCNC3=C1c1ccc(Cl)cc1
Systematic name  (3)：
  • 2-(4-クロロフェニル)-3β-シアノ-1,8b-(イミノエタノ)-3,3a,4,8b-テトラヒドロシクロペンタ[b]インドール-3α-カルボン酸メチル
  • メチル (10S)-11-(4-クロロフェニル)-10-シアノ-8,13-ジアザテトラシクロ[7.6.0.01,12.02,7]ペンタデカ-2,4,6,11-テトラエン-10-カルボキシラート
  • methyl (10S)-11-(4-chlorophenyl)-10-cyano-8,13-diazatetracyclo[7.6.0.01,12.02,7]pentadeca-2,4,6,11-tetraene-10-carboxylate
Other name (1)：
  • 2-(4-Chlorophenyl)-3β-cyano-1,8b-(iminoethano)-3,3a,4,8b-tetrahydrocyclopenta[b]indole-3α-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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