1-(5-phenyl-1,2-dihydropyrazol-3-ylidene)-2-(trifluoromethyl)benzimidazol-1-ium

Systemtic Name: 1-(5-phenyl-1,2-dihydropyrazol-3-ylidene)-2-(trifluoromethyl)benzimidazol-1-ium Openeye Name: 1-(5-phenyl-1,2-dihydropyrazol-3-ylidene)-2-(trifluoromethyl)benzimidazol-1-ium CAS Name: 1-(5-phenyl-1,2-dihydropyrazol-3-ylidene)-2-(trifluoromethyl)benzimidazol-1-ium IUPAC Name: 1-(5-phenyl-1,2-dihydropyrazol-3-ylidene)-2-(trifluoromethyl)benzimidazol-1-ium Traditional Name: 1-(5-phenyl-3-pyrazolin-3-ylidene)-2-(trifluoromethyl)benzimidazol-1-ium Formula: C17H12F3N4+ MolecularWeight: 329.29919

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+]3C4=CC=CC=C4N=C3C(F)(F)F)NN2

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+]3C4=CC=CC=C4N=C3C(F)(F)F)NN2

InChI

InChI=1S/C17H11F3N4/c18-17(19,20)16-21-12-8-4-5-9-14(12)24(16)15-10-13(22-23-15)11-6-2-1-3-7-11/h1-10H,(H,22,23)/p+1