1-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-methyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chloro-4-fluorophenyl)-5-methyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-methylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-methyl-pyrazole-4-carboxylic acid Formula: C11H8ClFN2O2 MolecularWeight: 254.644823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC(=C(C=C2)F)Cl)C(=O)O

Isomeric SMILES

CC1=C(C=NN1C2=CC(=C(C=C2)F)Cl)C(=O)O

InChI

InChI=1S/C11H8ClFN2O2/c1-6-8(11(16)17)5-14-15(6)7-2-3-10(13)9(12)4-7/h2-5H,1H3,(H,16,17)