1-[3-(2,3-dimethylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[3-(2,3-dimethylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[3-(2,3-dimethylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[3-(2,3-dimethylphenyl)-1-oxo-3,3-diphenylpropyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[3-(2,3-dimethylphenyl)-3,3-diphenylpropanoyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[3-(2,3-dimethylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-isonipecotonitrile Formula: C35H34N2O MolecularWeight: 498.65726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(CC(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(CC(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C35H34N2O/c1-27-13-12-20-32(28(27)2)35(30-16-8-4-9-17-30,31-18-10-5-11-19-31)25-33(38)37-23-21-34(26-36,22-24-37)29-14-6-3-7-15-29/h3-20H,21-25H2,1-2H3