(1-azanyl-1-oxidanylidene-propan-2-yl) 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C13H12FN3O3 MolecularWeight: 277.251083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC(=NN1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CC(=NN1)C2=CC=C(C=C2)F

InChI

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