2-[carboxymethyl-[[4-methoxycarbonyl-2,3-bis(oxidanyl)phenyl]methyl]amino]ethanoic acid

Systemtic Name: 2-[carboxymethyl-[[4-methoxycarbonyl-2,3-bis(oxidanyl)phenyl]methyl]amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[(2,3-dihydroxy-4-methoxycarbonyl-phenyl)methyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[(2,3-dihydroxy-4-methoxycarbonylphenyl)methyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[(2,3-dihydroxy-4-methoxycarbonylphenyl)methyl]amino]acetic acid Traditional Name: 2-[(4-carbomethoxy-2,3-dihydroxy-benzyl)-(carboxymethyl)amino]acetic acid Formula: C13H15NO8 MolecularWeight: 313.2601

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)CN(CC(=O)O)CC(=O)O)O)O

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)CN(CC(=O)O)CC(=O)O)O)O

InChI

InChI=1S/C13H15NO8/c1-22-13(21)8-3-2-7(11(19)12(8)20)4-14(5-9(15)16)6-10(17)18/h2-3,19-20H,4-6H2,1H3,(H,15,16)(H,17,18)