[5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 4-(trifluoromethyl)benzoate

Systemtic Name: [5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 4-(trifluoromethyl)benzoate Openeye Name: [5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid [5-(2-benzimidazolylidene)-1,2-dihydropyrazol-3-yl] ester IUPAC Name: [5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid [5-(benzimidazol-2-ylidene)-3-pyrazolin-3-yl] ester Formula: C18H11F3N4O2 MolecularWeight: 372.30075

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=C3C=C(NN3)OC(=O)C4=CC=C(C=C4)C(F)(F)F)N=C2C=C1

Isomeric SMILES

C1=CC2=NC(=C3C=C(NN3)OC(=O)C4=CC=C(C=C4)C(F)(F)F)N=C2C=C1

InChI

InChI=1S/C18H11F3N4O2/c19-18(20,21)11-7-5-10(6-8-11)17(26)27-15-9-14(24-25-15)16-22-12-3-1-2-4-13(12)23-16/h1-9,24-25H