5-[bis(phenylmethyl)amino]-2-(4-chlorophenyl)-2-cyclohexyl-heptanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-(4-chlorophenyl)-2-cyclohexyl-heptanenitrile Openeye Name: 2-(4-chlorophenyl)-2-cyclohexyl-5-(dibenzylamino)heptanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-(4-chlorophenyl)-2-cyclohexylheptanenitrile IUPAC Name: 2-(4-chlorophenyl)-2-cyclohexyl-5-(dibenzylamino)heptanenitrile Traditional Name: 2-(4-chlorophenyl)-2-cyclohexyl-5-(dibenzylamino)enanthonitrile Formula: C33H39ClN2 MolecularWeight: 499.12916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CCCCC1)C2=CC=C(C=C2)Cl)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC(CCC(C#N)(C1CCCCC1)C2=CC=C(C=C2)Cl)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C33H39ClN2/c1-2-32(36(24-27-12-6-3-7-13-27)25-28-14-8-4-9-15-28)22-23-33(26-35,29-16-10-5-11-17-29)30-18-20-31(34)21-19-30/h3-4,6-9,12-15,18-21,29,32H,2,5,10-11,16-17,22-25H2,1H3