[1-[[2,4-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 1H-pyrazole-5-carboxylate

Systemtic Name: [1-[[2,4-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 1H-pyrazole-5-carboxylate Openeye Name: [2-(2,4-difluoroanilino)-1-methyl-2-oxo-ethyl] 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid [1-(2,4-difluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-difluoroanilino)-1-oxopropan-2-yl] 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid [2-(2,4-difluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C13H11F2N3O3 MolecularWeight: 295.241546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)F)OC(=O)C2=CC=NN2

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)F)F)OC(=O)C2=CC=NN2

InChI

InChI=1S/C13H11F2N3O3/c1-7(21-13(20)11-4-5-16-18-11)12(19)17-10-3-2-8(14)6-9(10)15/h2-7H,1H3,(H,16,18)(H,17,19)