4-(3-acetamidopropanoylamino)-5-chloranyl-2-methoxy-benzoic acid

Systemtic Name: 4-(3-acetamidopropanoylamino)-5-chloranyl-2-methoxy-benzoic acid Openeye Name: 4-(3-acetamidopropanoylamino)-5-chloro-2-methoxy-benzoic acid CAS Name: 4-[(3-acetamido-1-oxopropyl)amino]-5-chloro-2-methoxybenzoic acid IUPAC Name: 4-(3-acetamidopropanoylamino)-5-chloro-2-methoxybenzoic acid Traditional Name: 4-(3-acetamidopropanoylamino)-5-chloro-2-methoxy-benzoic acid Formula: C13H15ClN2O5 MolecularWeight: 314.7216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN2O5/c1-7(17)15-4-3-12(18)16-10-6-11(21-2)8(13(19)20)5-9(10)14/h5-6H,3-4H2,1-2H3,(H,15,17)(H,16,18)(H,19,20)