2,2-diphenyl-5-[4-(phenylmethyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 2,2-diphenyl-5-[4-(phenylmethyl)piperazin-1-yl]pentanenitrile Openeye Name: 5-(4-benzylpiperazin-1-yl)-2,2-diphenyl-pentanenitrile CAS Name: 2,2-diphenyl-5-[4-(phenylmethyl)-1-piperazinyl]pentanenitrile IUPAC Name: 5-(4-benzylpiperazin-1-yl)-2,2-diphenylpentanenitrile Traditional Name: 5-(4-benzylpiperazino)-2,2-diphenyl-valeronitrile Formula: C28H31N3 MolecularWeight: 409.56584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H31N3/c29-24-28(26-13-6-2-7-14-26,27-15-8-3-9-16-27)17-10-18-30-19-21-31(22-20-30)23-25-11-4-1-5-12-25/h1-9,11-16H,10,17-23H2