4-(2-acetamidopropanoylamino)-5-chloranyl-2-methoxy-benzoic acid

Systemtic Name: 4-(2-acetamidopropanoylamino)-5-chloranyl-2-methoxy-benzoic acid Openeye Name: 4-(2-acetamidopropanoylamino)-5-chloro-2-methoxy-benzoic acid CAS Name: 4-[(2-acetamido-1-oxopropyl)amino]-5-chloro-2-methoxybenzoic acid IUPAC Name: 4-(2-acetamidopropanoylamino)-5-chloro-2-methoxybenzoic acid Traditional Name: 4-(2-acetamidopropanoylamino)-5-chloro-2-methoxy-benzoic acid Formula: C13H15ClN2O5 MolecularWeight: 314.7216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C(=C1)OC)C(=O)O)Cl)NC(=O)C

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C(=C1)OC)C(=O)O)Cl)NC(=O)C

InChI

InChI=1S/C13H15ClN2O5/c1-6(15-7(2)17)12(18)16-10-5-11(21-3)8(13(19)20)4-9(10)14/h4-6H,1-3H3,(H,15,17)(H,16,18)(H,19,20)