(3S)-1-(4-chlorophenyl)carbonyl-N-(2,5-diethoxyphenyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-chlorophenyl)carbonyl-N-(2,5-diethoxyphenyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-chlorobenzoyl)-N-(2,5-diethoxyphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-[(4-chlorophenyl)-oxomethyl]-N-(2,5-diethoxyphenyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-chlorobenzoyl)-N-(2,5-diethoxyphenyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-chlorobenzoyl)-N-(2,5-diethoxyphenyl)nipecotamide Formula: C23H27ClN2O4 MolecularWeight: 430.92448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)[C@H]2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H27ClN2O4/c1-3-29-19-11-12-21(30-4-2)20(14-19)25-22(27)17-6-5-13-26(15-17)23(28)16-7-9-18(24)10-8-16/h7-12,14,17H,3-6,13,15H2,1-2H3,(H,25,27)/t17-/m0/s1