4-(2-methoxy-4-methyl-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-methoxy-4-methyl-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-methoxy-4-methyl-phenyl)-4-oxo-butanoic acid CAS Name: 4-(2-methoxy-4-methylphenyl)-4-oxobutanoic acid IUPAC Name: 4-(2-methoxy-4-methylphenyl)-4-oxobutanoic acid Traditional Name: 4-keto-4-(2-methoxy-4-methyl-phenyl)butyric acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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