4-imidazol-1-yl-1-(2-methylphenyl)butan-2-one

Systemtic Name: 4-imidazol-1-yl-1-(2-methylphenyl)butan-2-one Openeye Name: 4-imidazol-1-yl-1-(o-tolyl)butan-2-one CAS Name: 4-(1-imidazolyl)-1-(2-methylphenyl)-2-butanone IUPAC Name: 4-imidazol-1-yl-1-(2-methylphenyl)butan-2-one Traditional Name: 4-imidazol-1-yl-1-(o-tolyl)butan-2-one Formula: C14H16N2O MolecularWeight: 228.28964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)CCN2C=CN=C2

Isomeric SMILES

CC1=CC=CC=C1CC(=O)CCN2C=CN=C2

InChI

InChI=1S/C14H16N2O/c1-12-4-2-3-5-13(12)10-14(17)6-8-16-9-7-15-11-16/h2-5,7,9,11H,6,8,10H2,1H3