5-[(4-fluoranyl-2-methyl-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-[(4-fluoranyl-2-methyl-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid Openeye Name: 5-[(4-fluoro-2-methyl-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid CAS Name: 5-[(4-fluoro-2-methylanilino)-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid IUPAC Name: 5-[(4-fluoro-2-methylphenyl)carbamoyl]-2-methylpyrazole-3-carboxylic acid Traditional Name: 5-[(4-fluoro-2-methyl-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid Formula: C13H12FN3O3 MolecularWeight: 277.251083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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