2-acetamido-3-(2-chloranyl-3,4-dimethoxy-phenyl)propanoic acid

Systemtic Name: 2-acetamido-3-(2-chloranyl-3,4-dimethoxy-phenyl)propanoic acid Openeye Name: 2-acetamido-3-(2-chloro-3,4-dimethoxy-phenyl)propanoic acid CAS Name: 2-acetamido-3-(2-chloro-3,4-dimethoxyphenyl)propanoic acid IUPAC Name: 2-acetamido-3-(2-chloro-3,4-dimethoxyphenyl)propanoic acid Traditional Name: 2-acetamido-3-(2-chloro-3,4-dimethoxy-phenyl)propionic acid Formula: C13H16ClNO5 MolecularWeight: 301.72284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(C(=C(C=C1)OC)OC)Cl)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=C(C(=C(C=C1)OC)OC)Cl)C(=O)O

InChI

InChI=1S/C13H16ClNO5/c1-7(16)15-9(13(17)18)6-8-4-5-10(19-2)12(20-3)11(8)14/h4-5,9H,6H2,1-3H3,(H,15,16)(H,17,18)