2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-acetic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoacetic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoacetic acid Traditional Name: 2-(homoveratrylamino)-2-keto-acetic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C(=O)O)OC

InChI

InChI=1S/C12H15NO5/c1-17-9-4-3-8(7-10(9)18-2)5-6-13-11(14)12(15)16/h3-4,7H,5-6H2,1-2H3,(H,13,14)(H,15,16)