2,4-bis(chloranyl)-3-(5-ethanoyl-2-methyl-pyrazol-3-yl)benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-3-(5-ethanoyl-2-methyl-pyrazol-3-yl)benzoic acid Openeye Name: 3-(5-acetyl-2-methyl-pyrazol-3-yl)-2,4-dichloro-benzoic acid CAS Name: 3-(5-acetyl-2-methyl-3-pyrazolyl)-2,4-dichlorobenzoic acid IUPAC Name: 3-(5-acetyl-2-methylpyrazol-3-yl)-2,4-dichlorobenzoic acid Traditional Name: 3-(5-acetyl-2-methyl-pyrazol-3-yl)-2,4-dichloro-benzoic acid Formula: C13H10Cl2N2O3 MolecularWeight: 313.1361

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=C1)C2=C(C=CC(=C2Cl)C(=O)O)Cl)C

Isomeric SMILES

CC(=O)C1=NN(C(=C1)C2=C(C=CC(=C2Cl)C(=O)O)Cl)C

InChI

InChI=1S/C13H10Cl2N2O3/c1-6(18)9-5-10(17(2)16-9)11-8(14)4-3-7(12(11)15)13(19)20/h3-5H,1-2H3,(H,19,20)