(3S)-1-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[2-(2-methylanilino)-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[2-(2-methylanilino)-2-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(2-methylanilino)-2-oxoethyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[2-keto-2-(o-toluidino)ethyl]-N-phenyl-nipecotamide Formula: C21H25N3O2 MolecularWeight: 351.4421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CN2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CN2CCC[C@@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-16-8-5-6-12-19(16)23-20(25)15-24-13-7-9-17(14-24)21(26)22-18-10-3-2-4-11-18/h2-6,8,10-12,17H,7,9,13-15H2,1H3,(H,22,26)(H,23,25)/t17-/m0/s1