2-(4-bromophenyl)-5-[(phenylmethyl)-propyl-amino]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(4-bromophenyl)-5-[(phenylmethyl)-propyl-amino]-2-propan-2-yl-pentanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-(4-bromophenyl)-2-isopropyl-pentanenitrile CAS Name: 2-(4-bromophenyl)-5-[(phenylmethyl)-propylamino]-2-propan-2-ylpentanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-(4-bromophenyl)-2-propan-2-ylpentanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-(4-bromophenyl)-2-isopropyl-valeronitrile Formula: C24H31BrN2 MolecularWeight: 427.42034

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1=CC=C(C=C1)Br)C(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCCN(CCCC(C#N)(C1=CC=C(C=C1)Br)C(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C24H31BrN2/c1-4-16-27(18-21-9-6-5-7-10-21)17-8-15-24(19-26,20(2)3)22-11-13-23(25)14-12-22/h5-7,9-14,20H,4,8,15-18H2,1-3H3