ethyl 1-[(E)-4-cyano-4,4-diphenyl-but-2-enyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(E)-4-cyano-4,4-diphenyl-but-2-enyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[(E)-4-cyano-4,4-diphenyl-but-2-enyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(E)-4-cyano-4,4-diphenylbut-2-enyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-4-cyano-4,4-diphenylbut-2-enyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[(E)-4-cyano-4,4-diphenyl-but-2-enyl]-4-phenyl-isonipecotic acid ethyl ester Formula: C31H32N2O2 MolecularWeight: 464.59798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC=CC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C/C=C/C(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H32N2O2/c1-2-35-29(34)30(26-13-6-3-7-14-26)20-23-33(24-21-30)22-12-19-31(25-32,27-15-8-4-9-16-27)28-17-10-5-11-18-28/h3-19H,2,20-24H2,1H3/b19-12+