2-(2-chloranyl-4-methyl-phenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylic acid

Systemtic Name: 2-(2-chloranyl-4-methyl-phenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylic acid Openeye Name: 2-(2-chloro-4-methyl-phenyl)-3-oxo-1H-pyrazole-5-carboxylic acid CAS Name: 2-(2-chloro-4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxylic acid IUPAC Name: 2-(2-chloro-4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxylic acid Traditional Name: 1-(2-chloro-4-methyl-phenyl)-5-keto-3-pyrazoline-3-carboxylic acid Formula: C11H9ClN2O3 MolecularWeight: 252.65376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C=C(N2)C(=O)O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C=C(N2)C(=O)O)Cl

InChI

InChI=1S/C11H9ClN2O3/c1-6-2-3-9(7(12)4-6)14-10(15)5-8(13-14)11(16)17/h2-5,13H,1H3,(H,16,17)