4-[[2-(carboxymethylamino)ethylamino]methyl]benzoic acid

Systemtic Name: 4-[[2-(carboxymethylamino)ethylamino]methyl]benzoic acid Openeye Name: 4-[[2-(carboxymethylamino)ethylamino]methyl]benzoic acid CAS Name: 4-[[2-(carboxymethylamino)ethylamino]methyl]benzoic acid IUPAC Name: 4-[[2-(carboxymethylamino)ethylamino]methyl]benzoic acid Traditional Name: 4-[[2-(carboxymethylamino)ethylamino]methyl]benzoic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCCNCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNCCNCC(=O)O)C(=O)O

InChI

InChI=1S/C12H16N2O4/c15-11(16)8-14-6-5-13-7-9-1-3-10(4-2-9)12(17)18/h1-4,13-14H,5-8H2,(H,15,16)(H,17,18)