5-[bis(phenylmethyl)amino]-2-(4-bromophenyl)-2-cyclopentyl-heptanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-(4-bromophenyl)-2-cyclopentyl-heptanenitrile Openeye Name: 2-(4-bromophenyl)-2-cyclopentyl-5-(dibenzylamino)heptanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-(4-bromophenyl)-2-cyclopentylheptanenitrile IUPAC Name: 2-(4-bromophenyl)-2-cyclopentyl-5-(dibenzylamino)heptanenitrile Traditional Name: 2-(4-bromophenyl)-2-cyclopentyl-5-(dibenzylamino)enanthonitrile Formula: C32H37BrN2 MolecularWeight: 529.55358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CCCC1)C2=CC=C(C=C2)Br)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC(CCC(C#N)(C1CCCC1)C2=CC=C(C=C2)Br)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C32H37BrN2/c1-2-31(35(23-26-11-5-3-6-12-26)24-27-13-7-4-8-14-27)21-22-32(25-34,28-15-9-10-16-28)29-17-19-30(33)20-18-29/h3-8,11-14,17-20,28,31H,2,9-10,15-16,21-24H2,1H3