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

Systemtic Name: 4-[(3,5-dimethoxyphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,5-dimethoxyanilino)-4-oxo-butanoic acid CAS Name: 4-(3,5-dimethoxyanilino)-4-oxobutanoic acid IUPAC Name: 4-(3,5-dimethoxyanilino)-4-oxobutanoic acid Traditional Name: 4-(3,5-dimethoxyanilino)-4-keto-butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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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)