5-[bis(phenylmethyl)amino]-2-(4-chlorophenyl)-2-cyclopropyl-pentanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-(4-chlorophenyl)-2-cyclopropyl-pentanenitrile Openeye Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-(dibenzylamino)pentanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-(4-chlorophenyl)-2-cyclopropylpentanenitrile IUPAC Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-(dibenzylamino)pentanenitrile Traditional Name: 2-(4-chlorophenyl)-2-cyclopropyl-5-(dibenzylamino)valeronitrile Formula: C28H29ClN2 MolecularWeight: 428.99626

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(CCCN(CC2=CC=CC=C2)CC3=CC=CC=C3)(C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1C(CCCN(CC2=CC=CC=C2)CC3=CC=CC=C3)(C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H29ClN2/c29-27-16-14-26(15-17-27)28(22-30,25-12-13-25)18-7-19-31(20-23-8-3-1-4-9-23)21-24-10-5-2-6-11-24/h1-6,8-11,14-17,25H,7,12-13,18-21H2