4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-N,N-dimethyl-2,2-diphenyl-butanamide; methyl 4-methylbenzenesulfonate

Systemtic Name: 4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-N,N-dimethyl-2,2-diphenyl-butanamide; methyl 4-methylbenzenesulfonate Openeye Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-N,N-dimethyl-2,2-diphenyl-butanamide; methyl 4-methylbenzenesulfonate CAS Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-N,N-dimethyl-2,2-diphenylbutanamide; 4-methylbenzenesulfonic acid methyl ester IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide; methyl 4-methylbenzenesulfonate Traditional Name: 4-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-N,N-dimethyl-2,2-diphenyl-butyramide; 4-methylbenzenesulfonic acid methyl ester Formula: C37H43ClN2O5S MolecularWeight: 663.26572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC.CN(C)C(=O)C(CCN1CCC(CC1)(C2=CC=C(C=C2)Cl)O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC.CN(C)C(=O)C(CCN1CCC(CC1)(C2=CC=C(C=C2)Cl)O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H33ClN2O2.C8H10O3S/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23;1-7-3-5-8(6-4-7)12(9,10)11-2/h3-16,34H,17-22H2,1-2H3;3-6H,1-2H3