5-[(4-fluoranyl-2-methyl-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[(4-fluoranyl-2-methyl-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[(4-fluoro-2-methyl-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[(4-fluoro-2-methylanilino)-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[(4-fluoro-2-methylphenyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[(4-fluoro-2-methyl-phenyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C13H12FN3O3 MolecularWeight: 277.251083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)C2=C(C=NN2C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)C2=C(C=NN2C)C(=O)O

InChI

InChI=1S/C13H12FN3O3/c1-7-5-8(14)3-4-10(7)16-12(18)11-9(13(19)20)6-15-17(11)2/h3-6H,1-2H3,(H,16,18)(H,19,20)