(3R)-1-[(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3R)-1-[(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3R)-1-[(1S)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3R)-1-[(2S)-1-(2-cyanoanilino)-1-oxopropan-2-yl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3R)-1-[(2S)-1-(2-cyanoanilino)-1-oxopropan-2-yl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3R)-1-[(1S)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl]-N-phenyl-nipecotamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C#N)N2CCC[C@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O2/c1-16(21(27)25-20-12-6-5-8-17(20)14-23)26-13-7-9-18(15-26)22(28)24-19-10-3-2-4-11-19/h2-6,8,10-12,16,18H,7,9,13,15H2,1H3,(H,24,28)(H,25,27)/t16-,18+/m0/s1