2-acetamido-3-[2,3-bis(chloranyl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 2-acetamido-3-[2,3-bis(chloranyl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 2-acetamido-3-(2,3-dichloro-4-hydroxy-phenyl)propanoic acid CAS Name: 2-acetamido-3-(2,3-dichloro-4-hydroxyphenyl)propanoic acid IUPAC Name: 2-acetamido-3-(2,3-dichloro-4-hydroxyphenyl)propanoic acid Traditional Name: 2-acetamido-3-(2,3-dichloro-4-hydroxy-phenyl)propionic acid Formula: C11H11Cl2NO4 MolecularWeight: 292.11534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11Cl2NO4/c1-5(15)14-7(11(17)18)4-6-2-3-8(16)10(13)9(6)12/h2-3,7,16H,4H2,1H3,(H,14,15)(H,17,18)