1-[3-(4-tert-butylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-[3-(4-tert-butylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-[3-(4-tert-butylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-[3-(4-tert-butylphenyl)-1-oxo-3,3-diphenylpropyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-[3-(4-tert-butylphenyl)-3,3-diphenylpropanoyl]-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-[3-(4-tert-butylphenyl)-3,3-diphenyl-propanoyl]-4-phenyl-isonipecotonitrile Formula: C37H38N2O MolecularWeight: 526.71042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H38N2O/c1-35(2,3)29-19-21-33(22-20-29)37(31-15-9-5-10-16-31,32-17-11-6-12-18-32)27-34(40)39-25-23-36(28-38,24-26-39)30-13-7-4-8-14-30/h4-22H,23-27H2,1-3H3