ethyl 5-azanyl-1-[2,4-bis(fluoranyl)phenyl]-4-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[2,4-bis(fluoranyl)phenyl]-4-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-amino-1-(2,4-difluorophenyl)-4-methyl-pyrazole-3-carboxylate CAS Name: 5-amino-1-(2,4-difluorophenyl)-4-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-(2,4-difluorophenyl)-4-methylpyrazole-3-carboxylate Traditional Name: 5-amino-1-(2,4-difluorophenyl)-4-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C13H13F2N3O2 MolecularWeight: 281.258026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C)N)C2=C(C=C(C=C2)F)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C)N)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C13H13F2N3O2/c1-3-20-13(19)11-7(2)12(16)18(17-11)10-5-4-8(14)6-9(10)15/h4-6H,3,16H2,1-2H3