2-[[5-acetamido-3-[[bis(carboxymethyl)amino]methyl]-2-oxidanyl-phenyl]methyl-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[5-acetamido-3-[[bis(carboxymethyl)amino]methyl]-2-oxidanyl-phenyl]methyl-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[[5-acetamido-3-[[bis(carboxymethyl)amino]methyl]-2-hydroxy-phenyl]methyl-(carboxymethyl)amino]acetic acid CAS Name: 2-[[5-acetamido-3-[[bis(carboxymethyl)amino]methyl]-2-hydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid IUPAC Name: 2-[[5-acetamido-3-[[bis(carboxymethyl)amino]methyl]-2-hydroxyphenyl]methyl-(carboxymethyl)amino]acetic acid Traditional Name: 2-[[5-acetamido-3-[[bis(carboxymethyl)amino]methyl]-2-hydroxy-benzyl]-(carboxymethyl)amino]acetic acid Formula: C18H23N3O10 MolecularWeight: 441.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C(=C1)CN(CC(=O)O)CC(=O)O)O)CN(CC(=O)O)CC(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C(=C1)CN(CC(=O)O)CC(=O)O)O)CN(CC(=O)O)CC(=O)O

InChI

InChI=1S/C18H23N3O10/c1-10(22)19-13-2-11(4-20(6-14(23)24)7-15(25)26)18(31)12(3-13)5-21(8-16(27)28)9-17(29)30/h2-3,31H,4-9H2,1H3,(H,19,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30)