(2S)-N-[(1S)-1-cyano-2-[4-(3-cyanophenyl)phenyl]ethyl]piperidine-2-carboxamide

Systemtic Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-cyanophenyl)phenyl]ethyl]piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-cyanophenyl)phenyl]ethyl]piperidine-2-carboxamide CAS Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-cyanophenyl)phenyl]ethyl]-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-cyanophenyl)phenyl]ethyl]piperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-1-cyano-2-[4-(3-cyanophenyl)phenyl]ethyl]pipecolinamide Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC(=C3)C#N)C#N

Isomeric SMILES

C1CCN[C@@H](C1)C(=O)N[C@@H](CC2=CC=C(C=C2)C3=CC=CC(=C3)C#N)C#N

InChI

InChI=1S/C22H22N4O/c23-14-17-4-3-5-19(12-17)18-9-7-16(8-10-18)13-20(15-24)26-22(27)21-6-1-2-11-25-21/h3-5,7-10,12,20-21,25H,1-2,6,11,13H2,(H,26,27)/t20-,21-/m0/s1