2-(4-bromophenyl)-4-methyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(4-bromophenyl)-4-methyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-(4-bromophenyl)-4-methyl-3-oxo-pentanenitrile CAS Name: 2-(4-bromophenyl)-4-methyl-3-oxopentanenitrile IUPAC Name: 2-(4-bromophenyl)-4-methyl-3-oxopentanenitrile Traditional Name: 2-(4-bromophenyl)-3-keto-4-methyl-valeronitrile Formula: C12H12BrNO MolecularWeight: 266.13378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C#N)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)C(=O)C(C#N)C1=CC=C(C=C1)Br

InChI

InChI=1S/C12H12BrNO/c1-8(2)12(15)11(7-14)9-3-5-10(13)6-4-9/h3-6,8,11H,1-2H3