5-chloranyl-1-(4-methylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-chloranyl-1-(4-methylphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-chloro-1-(p-tolyl)pyrazole-3-carboxylic acid CAS Name: 5-chloro-1-(4-methylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-chloro-1-(4-methylphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-chloro-1-(p-tolyl)pyrazole-3-carboxylic acid Formula: C11H9ClN2O2 MolecularWeight: 236.65436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9ClN2O2/c1-7-2-4-8(5-3-7)14-10(12)6-9(13-14)11(15)16/h2-6H,1H3,(H,15,16)