methyl 2-acetamido-3-[3,4-bis(oxidanyl)phenyl]propanoate

Systemtic Name: methyl 2-acetamido-3-[3,4-bis(oxidanyl)phenyl]propanoate Openeye Name: methyl 2-acetamido-3-(3,4-dihydroxyphenyl)propanoate CAS Name: 2-acetamido-3-(3,4-dihydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-(3,4-dihydroxyphenyl)propanoate Traditional Name: 2-acetamido-3-(3,4-dihydroxyphenyl)propionic acid methyl ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=C(C=C1)O)O)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=CC(=C(C=C1)O)O)C(=O)OC

InChI

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