3-[(2-chloranyl-6-ethanoyl-3,4-dimethoxy-phenyl)amino]propanoic acid

Systemtic Name: 3-[(2-chloranyl-6-ethanoyl-3,4-dimethoxy-phenyl)amino]propanoic acid Openeye Name: 3-(6-acetyl-2-chloro-3,4-dimethoxy-anilino)propanoic acid CAS Name: 3-(6-acetyl-2-chloro-3,4-dimethoxyanilino)propanoic acid IUPAC Name: 3-(6-acetyl-2-chloro-3,4-dimethoxyanilino)propanoic acid Traditional Name: 3-(6-acetyl-2-chloro-3,4-dimethoxy-anilino)propionic acid Formula: C13H16ClNO5 MolecularWeight: 301.72284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1NCCC(=O)O)Cl)OC)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1NCCC(=O)O)Cl)OC)OC

InChI

InChI=1S/C13H16ClNO5/c1-7(16)8-6-9(19-2)13(20-3)11(14)12(8)15-5-4-10(17)18/h6,15H,4-5H2,1-3H3,(H,17,18)