(3S)-N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-chlorophenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-chlorophenyl)carbonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-chlorobenzoyl)piperidine-3-carboxamide CAS Name: (3S)-N-(5-tert-butyl-2-methoxyphenyl)-1-[(4-chlorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(5-tert-butyl-2-methoxyphenyl)-1-(4-chlorobenzoyl)piperidine-3-carboxamide Traditional Name: (3S)-N-(5-tert-butyl-2-methoxy-phenyl)-1-(4-chlorobenzoyl)nipecotamide Formula: C24H29ClN2O3 MolecularWeight: 428.95166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29ClN2O3/c1-24(2,3)18-9-12-21(30-4)20(14-18)26-22(28)17-6-5-13-27(15-17)23(29)16-7-10-19(25)11-8-16/h7-12,14,17H,5-6,13,15H2,1-4H3,(H,26,28)/t17-/m0/s1