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

Systemtic Name: 2-(4-bromophenyl)-5-[phenethyl(propyl)amino]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(4-bromophenyl)-2-isopropyl-5-[phenethyl(propyl)amino]pentanenitrile CAS Name: 2-(4-bromophenyl)-5-[phenethyl(propyl)amino]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(4-bromophenyl)-5-[phenethyl(propyl)amino]-2-propan-2-ylpentanenitrile Traditional Name: 2-(4-bromophenyl)-2-isopropyl-5-[phenethyl(propyl)amino]valeronitrile Formula: C25H33BrN2 MolecularWeight: 441.44692

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1=CC=C(C=C1)Br)C(C)C)CCC2=CC=CC=C2

Isomeric SMILES

CCCN(CCCC(C#N)(C1=CC=C(C=C1)Br)C(C)C)CCC2=CC=CC=C2

InChI

InChI=1S/C25H33BrN2/c1-4-17-28(19-15-22-9-6-5-7-10-22)18-8-16-25(20-27,21(2)3)23-11-13-24(26)14-12-23/h5-7,9-14,21H,4,8,15-19H2,1-3H3