2-[(4-azanyl-3-oxidanyl-phenyl)carbonylamino]-3-[3,4-bis(oxidanyl)phenyl]propanoic acid

Systemtic Name: 2-[(4-azanyl-3-oxidanyl-phenyl)carbonylamino]-3-[3,4-bis(oxidanyl)phenyl]propanoic acid Openeye Name: 2-[(4-amino-3-hydroxy-benzoyl)amino]-3-(3,4-dihydroxyphenyl)propanoic acid CAS Name: 2-[[(4-amino-3-hydroxyphenyl)-oxomethyl]amino]-3-(3,4-dihydroxyphenyl)propanoic acid IUPAC Name: 2-[(4-amino-3-hydroxybenzoyl)amino]-3-(3,4-dihydroxyphenyl)propanoic acid Traditional Name: 2-[(4-amino-3-hydroxy-benzoyl)amino]-3-(3,4-dihydroxyphenyl)propionic acid Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(C(=O)O)NC(=O)C2=CC(=C(C=C2)N)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1CC(C(=O)O)NC(=O)C2=CC(=C(C=C2)N)O)O)O

InChI

InChI=1S/C16H16N2O6/c17-10-3-2-9(7-13(10)20)15(22)18-11(16(23)24)5-8-1-4-12(19)14(21)6-8/h1-4,6-7,11,19-21H,5,17H2,(H,18,22)(H,23,24)