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

Systemtic Name: 4-[[2-(2-carboxyethylamino)ethylamino]methyl]benzoic acid Openeye Name: 4-[[2-(2-carboxyethylamino)ethylamino]methyl]benzoic acid CAS Name: 4-[[2-(2-carboxyethylamino)ethylamino]methyl]benzoic acid IUPAC Name: 4-[[2-(2-carboxyethylamino)ethylamino]methyl]benzoic acid Traditional Name: 4-[[2-(2-carboxyethylamino)ethylamino]methyl]benzoic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCCNCCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNCCNCCC(=O)O)C(=O)O

InChI

InChI=1S/C13H18N2O4/c16-12(17)5-6-14-7-8-15-9-10-1-3-11(4-2-10)13(18)19/h1-4,14-15H,5-9H2,(H,16,17)(H,18,19)