3-(3-acetamidopropanoylamino)benzoic acid

Systemtic Name: 3-(3-acetamidopropanoylamino)benzoic acid Openeye Name: 3-(3-acetamidopropanoylamino)benzoic acid CAS Name: 3-[(3-acetamido-1-oxopropyl)amino]benzoic acid IUPAC Name: 3-(3-acetamidopropanoylamino)benzoic acid Traditional Name: 3-(3-acetamidopropanoylamino)benzoic acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4/c1-8(15)13-6-5-11(16)14-10-4-2-3-9(7-10)12(17)18/h2-4,7H,5-6H2,1H3,(H,13,15)(H,14,16)(H,17,18)