4-[(3,5-dimethoxyphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3,5-dimethoxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-(3,5-dimethoxyanilino)-4-oxo-butanoate CAS Name: 4-(3,5-dimethoxyanilino)-4-oxobutanoate IUPAC Name: 4-(3,5-dimethoxyanilino)-4-oxobutanoate Traditional Name: 4-(3,5-dimethoxyanilino)-4-keto-butyrate Formula: C12H14NO5- MolecularWeight: 252.24326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5/c1-17-9-5-8(6-10(7-9)18-2)13-11(14)3-4-12(15)16/h5-7H,3-4H2,1-2H3,(H,13,14)(H,15,16)/p-1