propyl 4-[[1-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[1-(4-methylphenyl)-5-(trifluoromethyl)pyrazol-4-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]benzoic acid propyl ester Formula: C22H20F3N3O3 MolecularWeight: 431.40771

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(F)(F)F

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)C)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O3/c1-3-12-31-21(30)15-6-8-16(9-7-15)27-20(29)18-13-26-28(19(18)22(23,24)25)17-10-4-14(2)5-11-17/h4-11,13H,3,12H2,1-2H3,(H,27,29)