5-acetamido-2-(2-carboxyethyl)benzoic acid

Systemtic Name: 5-acetamido-2-(2-carboxyethyl)benzoic acid Openeye Name: 5-acetamido-2-(2-carboxyethyl)benzoic acid CAS Name: 5-acetamido-2-(2-carboxyethyl)benzoic acid IUPAC Name: 5-acetamido-2-(2-carboxyethyl)benzoic acid Traditional Name: 5-acetamido-2-(2-carboxyethyl)benzoic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-7(14)13-9-4-2-8(3-5-11(15)16)10(6-9)12(17)18/h2,4,6H,3,5H2,1H3,(H,13,14)(H,15,16)(H,17,18)