1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-3-(phenylsulfinyl)piperidin-2-one

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-3-(phenylsulfinyl)piperidin-2-one Openeye Name: 3-(benzenesulfinyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-piperidin-2-one CAS Name: 3-(benzenesulfinyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-piperidinone IUPAC Name: 3-(benzenesulfinyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethylpiperidin-2-one Traditional Name: 3-(benzenesulfinyl)-5-ethyl-1-homoveratryl-2-piperidone Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C(=O)N(C1)CCC2=CC(=C(C=C2)OC)OC)S(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1CC(C(=O)N(C1)CCC2=CC(=C(C=C2)OC)OC)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29NO4S/c1-4-17-15-22(29(26)19-8-6-5-7-9-19)23(25)24(16-17)13-12-18-10-11-20(27-2)21(14-18)28-3/h5-11,14,17,22H,4,12-13,15-16H2,1-3H3