(2S,3S,9aS)-2-chloranyl-3-methoxy-9-(phenylsulfonyl)-3,9a-dihydro-1H-carbazole-2-carbonitrile

Systemtic Name: (2S,3S,9aS)-2-chloranyl-3-methoxy-9-(phenylsulfonyl)-3,9a-dihydro-1H-carbazole-2-carbonitrile Openeye Name: (2S,3S,9aS)-9-(benzenesulfonyl)-2-chloro-3-methoxy-3,9a-dihydro-1H-carbazole-2-carbonitrile CAS Name: (2S,3S,9aS)-9-(benzenesulfonyl)-2-chloro-3-methoxy-3,9a-dihydro-1H-carbazole-2-carbonitrile IUPAC Name: (2S,3S,9aS)-9-(benzenesulfonyl)-2-chloro-3-methoxy-3,9a-dihydro-1H-carbazole-2-carbonitrile Traditional Name: (2S,3S,9aS)-9-besyl-2-chloro-3-methoxy-3,9a-dihydro-1H-carbazole-2-carbonitrile Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

COC1C=C2C(CC1(C#N)Cl)N(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CO[C@H]1C=C2[C@H](C[C@@]1(C#N)Cl)N(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN2O3S/c1-26-19-11-16-15-9-5-6-10-17(15)23(18(16)12-20(19,21)13-22)27(24,25)14-7-3-2-4-8-14/h2-11,18-19H,12H2,1H3/t18-,19-,20-/m0/s1