5-[bis(phenylmethyl)amino]-2-(4-bromophenyl)-2-cyclohexyl-hexanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-(4-bromophenyl)-2-cyclohexyl-hexanenitrile Openeye Name: 2-(4-bromophenyl)-2-cyclohexyl-5-(dibenzylamino)hexanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-(4-bromophenyl)-2-cyclohexylhexanenitrile IUPAC Name: 2-(4-bromophenyl)-2-cyclohexyl-5-(dibenzylamino)hexanenitrile Traditional Name: 2-(4-bromophenyl)-2-cyclohexyl-5-(dibenzylamino)hexanenitrile Formula: C32H37BrN2 MolecularWeight: 529.55358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H37BrN2/c1-26(35(23-27-11-5-2-6-12-27)24-28-13-7-3-8-14-28)21-22-32(25-34,29-15-9-4-10-16-29)30-17-19-31(33)20-18-30/h2-3,5-8,11-14,17-20,26,29H,4,9-10,15-16,21-24H2,1H3