2-[[4-[[bis(carboxymethyl)amino]methyl]-2,5-bis(oxidanyl)phenyl]methyl-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,5-bis(oxidanyl)phenyl]methyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,5-dihydroxy-phenyl]methyl-(carboxymethyl)amino]acetic acid CAS Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,5-dihydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,5-dihydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[4-[[bis(carboxymethyl)amino]methyl]-2,5-dihydroxy-benzyl]-(carboxymethyl)amino]acetic acid Formula: C16H20N2O10 MolecularWeight: 400.3374

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1O)CN(CC(=O)O)CC(=O)O)O)CN(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1O)CN(CC(=O)O)CC(=O)O)O)CN(CC(=O)O)CC(=O)O

InChI

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