1,6-dimethyl-9-(phenylsulfonyl)-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole

Systemtic Name: 1,6-dimethyl-9-(phenylsulfonyl)-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole Openeye Name: 9-(benzenesulfonyl)-1,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole CAS Name: 9-(benzenesulfonyl)-1,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole IUPAC Name: 9-(benzenesulfonyl)-1,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole Traditional Name: 9-besyl-1,6-dimethyl-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indole Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCC2=C1C3=C(N2C)C=CC(=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CNCCC2=C1C3=C(N2C)C=CC(=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H22N2O2S/c1-14-13-21-11-10-19-20(14)17-12-16(8-9-18(17)22(19)2)25(23,24)15-6-4-3-5-7-15/h3-9,12,14,21H,10-11,13H2,1-2H3