(2-azanyl-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 1-(4-fluorophenyl)-3-(p-tolyl)pyrazole-4-carboxylate CAS Name: 1-(4-fluorophenyl)-3-(4-methylphenyl)-4-pyrazolecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-(4-fluorophenyl)-3-(4-methylphenyl)pyrazole-4-carboxylate Traditional Name: 1-(4-fluorophenyl)-3-(p-tolyl)pyrazole-4-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C19H16FN3O3 MolecularWeight: 353.347043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H16FN3O3/c1-12-2-4-13(5-3-12)18-16(19(25)26-11-17(21)24)10-23(22-18)15-8-6-14(20)7-9-15/h2-10H,11H2,1H3,(H2,21,24)