3-[bis(2-carboxyethyl)amino]benzoic acid

Systemtic Name: 3-[bis(2-carboxyethyl)amino]benzoic acid Openeye Name: 3-[bis(2-carboxyethyl)amino]benzoic acid CAS Name: 3-[bis(2-carboxyethyl)amino]benzoic acid IUPAC Name: 3-[bis(2-carboxyethyl)amino]benzoic acid Traditional Name: 3-[bis(2-carboxyethyl)amino]benzoic acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(CCC(=O)O)CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N(CCC(=O)O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C13H15NO6/c15-11(16)4-6-14(7-5-12(17)18)10-3-1-2-9(8-10)13(19)20/h1-3,8H,4-7H2,(H,15,16)(H,17,18)(H,19,20)