4-(2,5-dimethoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(2,5-dimethoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: 4-(2,5-dimethoxyphenyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethoxyphenyl)-4-oxobutanoate IUPAC Name: 4-(2,5-dimethoxyphenyl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethoxyphenyl)-4-keto-butyrate Formula: C12H13O5- MolecularWeight: 237.22862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)CCC(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H14O5/c1-16-8-3-5-11(17-2)9(7-8)10(13)4-6-12(14)15/h3,5,7H,4,6H2,1-2H3,(H,14,15)/p-1