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

Systemtic Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-bis(oxidanyl)phenyl]methyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-dihydroxy-phenyl]methyl-(carboxymethyl)amino]acetic acid CAS Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-dihydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-dihydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,3-dihydroxy-benzyl]-(carboxymethyl)amino]acetic acid Formula: C16H20N2O10 MolecularWeight: 400.3374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1CN(CC(=O)O)CC(=O)O)O)O)CN(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1CN(CC(=O)O)CC(=O)O)O)O)CN(CC(=O)O)CC(=O)O

InChI

InChI=1S/C16H20N2O10/c19-11(20)5-17(6-12(21)22)3-9-1-2-10(16(28)15(9)27)4-18(7-13(23)24)8-14(25)26/h1-2,27-28H,3-8H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)