(3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(phenylsulfonyl)piperidin-3-amine

Systemtic Name: (3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(phenylsulfonyl)piperidin-3-amine Openeye Name: (3S)-1-(benzenesulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-3-amine CAS Name: (3S)-1-(benzenesulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-piperidinamine IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpiperidin-3-amine Traditional Name: [(3S)-1-besyl-3-piperidyl]-homoveratryl-methyl-amine Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O4S/c1-23(15-13-18-11-12-21(27-2)22(16-18)28-3)19-8-7-14-24(17-19)29(25,26)20-9-5-4-6-10-20/h4-6,9-12,16,19H,7-8,13-15,17H2,1-3H3/t19-/m0/s1