2-[2-(4-chlorophenyl)carbonyl-3-methyl-imidazol-4-yl]ethanenitrile

Systemtic Name: 2-[2-(4-chlorophenyl)carbonyl-3-methyl-imidazol-4-yl]ethanenitrile Openeye Name: 2-[2-(4-chlorobenzoyl)-3-methyl-imidazol-4-yl]acetonitrile CAS Name: 2-[2-[(4-chlorophenyl)-oxomethyl]-3-methyl-4-imidazolyl]acetonitrile IUPAC Name: 2-[2-(4-chlorobenzoyl)-3-methylimidazol-4-yl]acetonitrile Traditional Name: 2-[2-(4-chlorobenzoyl)-3-methyl-imidazol-4-yl]acetonitrile Formula: C13H10ClN3O MolecularWeight: 259.691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C(=O)C2=CC=C(C=C2)Cl)CC#N

Isomeric SMILES

CN1C(=CN=C1C(=O)C2=CC=C(C=C2)Cl)CC#N

InChI

InChI=1S/C13H10ClN3O/c1-17-11(6-7-15)8-16-13(17)12(18)9-2-4-10(14)5-3-9/h2-5,8H,6H2,1H3