2-[(3-methoxy-4-oxidanyl-phenyl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(3-methoxy-4-oxidanyl-phenyl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-hydroxy-3-methoxy-benzoyl)amino]acetic acid CAS Name: 2-[[(4-hydroxy-3-methoxyphenyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-hydroxy-3-methoxybenzoyl)amino]acetic acid Traditional Name: 2-(vanilloylamino)acetic acid Formula: C10H11NO5 MolecularWeight: 225.19804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCC(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCC(=O)O)O

InChI

InChI=1S/C10H11NO5/c1-16-8-4-6(2-3-7(8)12)10(15)11-5-9(13)14/h2-4,12H,5H2,1H3,(H,11,15)(H,13,14)