(2R,3S)-2-[(diphenylmethylidene)amino]-3-(4-methylphenyl)-5-oxidanylidene-5-phenyl-pentanenitrile

Systemtic Name: (2R,3S)-2-[(diphenylmethylidene)amino]-3-(4-methylphenyl)-5-oxidanylidene-5-phenyl-pentanenitrile Openeye Name: (2R,3S)-2-(benzhydrylideneamino)-5-oxo-5-phenyl-3-(p-tolyl)pentanenitrile CAS Name: (2R,3S)-2-[(diphenylmethylene)amino]-3-(4-methylphenyl)-5-oxo-5-phenylpentanenitrile IUPAC Name: (2R,3S)-2-(benzhydrylideneamino)-3-(4-methylphenyl)-5-oxo-5-phenylpentanenitrile Traditional Name: (2R,3S)-2-(benzhydrylideneamino)-5-keto-5-phenyl-3-(p-tolyl)valeronitrile Formula: C31H26N2O MolecularWeight: 442.55094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CC(=O)C2=CC=CC=C2)[C@H](C#N)N=C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H26N2O/c1-23-17-19-24(20-18-23)28(21-30(34)25-11-5-2-6-12-25)29(22-32)33-31(26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-20,28-29H,21H2,1H3/t28-,29-/m0/s1