3-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-[(4-fluorophenyl)methylcarbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-[[(4-fluorophenyl)methylamino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-[(4-fluorophenyl)methylcarbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-[(4-fluorobenzyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C13H12FN3O3 MolecularWeight: 277.251083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NCC2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NCC2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C13H12FN3O3/c1-17-7-10(13(19)20)11(16-17)12(18)15-6-8-2-4-9(14)5-3-8/h2-5,7H,6H2,1H3,(H,15,18)(H,19,20)