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

Systemtic Name: [5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 3,5-bis(trifluoromethyl)benzoate Openeye Name: [5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 3,5-bis(trifluoromethyl)benzoate CAS Name: 3,5-bis(trifluoromethyl)benzoic acid [5-(2-benzimidazolylidene)-1,2-dihydropyrazol-3-yl] ester IUPAC Name: [5-(benzimidazol-2-ylidene)-1,2-dihydropyrazol-3-yl] 3,5-bis(trifluoromethyl)benzoate Traditional Name: 3,5-bis(trifluoromethyl)benzoic acid [5-(benzimidazol-2-ylidene)-3-pyrazolin-3-yl] ester Formula: C19H10F6N4O2 MolecularWeight: 440.298719

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H10F6N4O2/c20-18(21,22)10-5-9(6-11(7-10)19(23,24)25)17(30)31-15-8-14(28-29-15)16-26-12-3-1-2-4-13(12)27-16/h1-8,28-29H