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

Systemtic Name: 4-oxidanylidene-4-(2,4,5-trimethoxyphenyl)butanoate Openeye Name: 4-oxo-4-(2,4,5-trimethoxyphenyl)butanoate CAS Name: 4-oxo-4-(2,4,5-trimethoxyphenyl)butanoate IUPAC Name: 4-oxo-4-(2,4,5-trimethoxyphenyl)butanoate Traditional Name: 4-asaryl-4-keto-butyrate Formula: C13H15O6- MolecularWeight: 267.2546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)CCC(=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)CCC(=O)[O-])OC)OC

InChI

InChI=1S/C13H16O6/c1-17-10-7-12(19-3)11(18-2)6-8(10)9(14)4-5-13(15)16/h6-7H,4-5H2,1-3H3,(H,15,16)/p-1