12-oxidanidyl-10-(trifluoromethyl)-5,6-dihydrobenzimidazolo[2,1-a]isoquinolin-12-ium

Systemtic Name: 12-oxidanidyl-10-(trifluoromethyl)-5,6-dihydrobenzimidazolo[2,1-a]isoquinolin-12-ium Openeye Name: 12-oxido-10-(trifluoromethyl)-5,6-dihydrobenzimidazolo[2,1-a]isoquinolin-12-ium CAS Name: 12-oxido-10-(trifluoromethyl)-5,6-dihydrobenzimidazolo[2,1-a]isoquinolin-12-ium IUPAC Name: 12-oxido-10-(trifluoromethyl)-5,6-dihydrobenzimidazolo[2,1-a]isoquinolin-12-ium Traditional Name: 12-oxido-10-(trifluoromethyl)-5,6-dihydrobenzimidazol[2,1-a]isoquinolin-12-ium Formula: C16H11F3N2O MolecularWeight: 304.26655

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C3=C(C=C(C=C3)C(F)(F)F)[N+](=C2C4=CC=CC=C41)[O-]

Isomeric SMILES

C1CN2C3=C(C=C(C=C3)C(F)(F)F)[N+](=C2C4=CC=CC=C41)[O-]

InChI

InChI=1S/C16H11F3N2O/c17-16(18,19)11-5-6-13-14(9-11)21(22)15-12-4-2-1-3-10(12)7-8-20(13)15/h1-6,9H,7-8H2