3,3-dimethyl-1-(1-methylpiperidin-4-yl)-5-(phenylsulfonyl)-2H-indole hydrochloride

Systemtic Name: 3,3-dimethyl-1-(1-methylpiperidin-4-yl)-5-(phenylsulfonyl)-2H-indole hydrochloride Openeye Name: 5-(benzenesulfonyl)-3,3-dimethyl-1-(1-methyl-4-piperidyl)indoline hydrochloride CAS Name: 5-(benzenesulfonyl)-3,3-dimethyl-1-(1-methyl-4-piperidinyl)-2H-indole hydrochloride IUPAC Name: 5-(benzenesulfonyl)-3,3-dimethyl-1-(1-methylpiperidin-4-yl)-2H-indole hydrochloride Traditional Name: 5-besyl-3,3-dimethyl-1-(1-methyl-4-piperidyl)indoline hydrochloride Formula: C22H29ClN2O2S MolecularWeight: 420.99586

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)C4CCN(CC4)C)C.Cl

Isomeric SMILES

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)C4CCN(CC4)C)C.Cl

InChI

InChI=1S/C22H28N2O2S.ClH/c1-22(2)16-24(17-11-13-23(3)14-12-17)21-10-9-19(15-20(21)22)27(25,26)18-7-5-4-6-8-18;/h4-10,15,17H,11-14,16H2,1-3H3;1H