ethyl 5-azanyl-1-[(4-fluorophenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[(4-fluorophenyl)methyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[(4-fluorophenyl)methyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[(4-fluorophenyl)methyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[(4-fluorophenyl)methyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-(4-fluorobenzyl)pyrazole-4-carboxylic acid ethyl ester Formula: C13H14FN3O2 MolecularWeight: 263.267563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC2=CC=C(C=C2)F)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC2=CC=C(C=C2)F)N

InChI

InChI=1S/C13H14FN3O2/c1-2-19-13(18)11-7-16-17(12(11)15)8-9-3-5-10(14)6-4-9/h3-7H,2,8,15H2,1H3