4-(4-methoxy-2-methyl-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(4-methoxy-2-methyl-phenyl)-4-oxidanylidene-butanoate Openeye Name: 4-(4-methoxy-2-methyl-phenyl)-4-oxo-butanoate CAS Name: 4-(4-methoxy-2-methylphenyl)-4-oxobutanoate IUPAC Name: 4-(4-methoxy-2-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(4-methoxy-2-methyl-phenyl)butyrate Formula: C12H13O4- MolecularWeight: 221.22922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H14O4/c1-8-7-9(16-2)3-4-10(8)11(13)5-6-12(14)15/h3-4,7H,5-6H2,1-2H3,(H,14,15)/p-1