methyl 4-(4-methoxy-3-methyl-phenyl)-2-oxidanylidene-butanoate

Systemtic Name: methyl 4-(4-methoxy-3-methyl-phenyl)-2-oxidanylidene-butanoate Openeye Name: methyl 4-(4-methoxy-3-methyl-phenyl)-2-oxo-butanoate CAS Name: 4-(4-methoxy-3-methylphenyl)-2-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-methoxy-3-methylphenyl)-2-oxobutanoate Traditional Name: 2-keto-4-(4-methoxy-3-methyl-phenyl)butyric acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCC(=O)C(=O)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CCC(=O)C(=O)OC)OC

InChI

InChI=1S/C13H16O4/c1-9-8-10(5-7-12(9)16-2)4-6-11(14)13(15)17-3/h5,7-8H,4,6H2,1-3H3