1-(1-methylazepan-4-yl)-5-(phenylsulfonyl)-2,3-dihydroindole hydrochloride

Systemtic Name: 1-(1-methylazepan-4-yl)-5-(phenylsulfonyl)-2,3-dihydroindole hydrochloride Openeye Name: 5-(benzenesulfonyl)-1-(1-methylazepan-4-yl)indoline hydrochloride CAS Name: 5-(benzenesulfonyl)-1-(1-methyl-4-azepanyl)-2,3-dihydroindole hydrochloride IUPAC Name: 5-(benzenesulfonyl)-1-(1-methylazepan-4-yl)-2,3-dihydroindole hydrochloride Traditional Name: 5-besyl-1-(1-methylazepan-4-yl)indoline hydrochloride Formula: C21H27ClN2O2S MolecularWeight: 406.96928

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(CC1)N2CCC3=C2C=CC(=C3)S(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

CN1CCCC(CC1)N2CCC3=C2C=CC(=C3)S(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H26N2O2S.ClH/c1-22-13-5-6-18(12-14-22)23-15-11-17-16-20(9-10-21(17)23)26(24,25)19-7-3-2-4-8-19;/h2-4,7-10,16,18H,5-6,11-15H2,1H3;1H