2-(3-acetamidopropanoylamino)-5-chloranyl-benzoic acid

Systemtic Name: 2-(3-acetamidopropanoylamino)-5-chloranyl-benzoic acid Openeye Name: 2-(3-acetamidopropanoylamino)-5-chloro-benzoic acid CAS Name: 2-[(3-acetamido-1-oxopropyl)amino]-5-chlorobenzoic acid IUPAC Name: 2-(3-acetamidopropanoylamino)-5-chlorobenzoic acid Traditional Name: 2-(3-acetamidopropanoylamino)-5-chloro-benzoic acid Formula: C12H13ClN2O4 MolecularWeight: 284.69562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O4/c1-7(16)14-5-4-11(17)15-10-3-2-8(13)6-9(10)12(18)19/h2-3,6H,4-5H2,1H3,(H,14,16)(H,15,17)(H,18,19)