2-[3,4-bis(bromanyl)phenyl]-2-cyclobutyl-5-[methyl-(phenylmethyl)amino]pentanenitrile

Systemtic Name: 2-[3,4-bis(bromanyl)phenyl]-2-cyclobutyl-5-[methyl-(phenylmethyl)amino]pentanenitrile Openeye Name: 5-[benzyl(methyl)amino]-2-cyclobutyl-2-(3,4-dibromophenyl)pentanenitrile CAS Name: 2-cyclobutyl-2-(3,4-dibromophenyl)-5-[methyl-(phenylmethyl)amino]pentanenitrile IUPAC Name: 5-[benzyl(methyl)amino]-2-cyclobutyl-2-(3,4-dibromophenyl)pentanenitrile Traditional Name: 5-[benzyl(methyl)amino]-2-cyclobutyl-2-(3,4-dibromophenyl)valeronitrile Formula: C23H26Br2N2 MolecularWeight: 490.27394

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C#N)(C1CCC1)C2=CC(=C(C=C2)Br)Br)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCC(C#N)(C1CCC1)C2=CC(=C(C=C2)Br)Br)CC3=CC=CC=C3

InChI

InChI=1S/C23H26Br2N2/c1-27(16-18-7-3-2-4-8-18)14-6-13-23(17-26,19-9-5-10-19)20-11-12-21(24)22(25)15-20/h2-4,7-8,11-12,15,19H,5-6,9-10,13-14,16H2,1H3