2-[[4-methyl-2-(phenylcarbonyl)phenyl]diazenyl]-3-oxidanylidene-butanoate

Systemtic Name: 2-[[4-methyl-2-(phenylcarbonyl)phenyl]diazenyl]-3-oxidanylidene-butanoate Openeye Name: 2-(2-benzoyl-4-methyl-phenyl)azo-3-oxo-butanoate CAS Name: 2-(2-benzoyl-4-methylphenyl)azo-3-oxobutanoate IUPAC Name: 2-[(2-benzoyl-4-methylphenyl)diazenyl]-3-oxobutanoate Traditional Name: 2-(2-benzoyl-4-methyl-phenyl)azo-3-keto-butyrate Formula: C18H15N2O4- MolecularWeight: 323.3227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=NC(C(=O)C)C(=O)[O-])C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)N=NC(C(=O)C)C(=O)[O-])C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H16N2O4/c1-11-8-9-15(19-20-16(12(2)21)18(23)24)14(10-11)17(22)13-6-4-3-5-7-13/h3-10,16H,1-2H3,(H,23,24)/p-1