2,3-dihydro-1H-isoindol-4-yl-oxidanylidene-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyridin-2-yl]azanium

Systemtic Name: 2,3-dihydro-1H-isoindol-4-yl-oxidanylidene-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyridin-2-yl]azanium Openeye Name: isoindolin-4-yl-oxo-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]-2-pyridyl]ammonium CAS Name: 2,3-dihydro-1H-isoindol-4-yl-oxo-[3-[oxo-[3-(trifluoromethyl)anilino]methyl]-2-pyridinyl]ammonium IUPAC Name: 2,3-dihydro-1H-isoindol-4-yl-oxo-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyridin-2-yl]azanium Traditional Name: isoindolin-4-yl-keto-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]-2-pyridyl]ammonium Formula: C21H16F3N4O2+ MolecularWeight: 413.37255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1)C(=CC=C2)[N+](=O)C3=C(C=CC=N3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1C2=C(CN1)C(=CC=C2)[N+](=O)C3=C(C=CC=N3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H15F3N4O2/c22-21(23,24)14-5-2-6-15(10-14)27-20(29)16-7-3-9-26-19(16)28(30)18-8-1-4-13-11-25-12-17(13)18/h1-10,25H,11-12H2/p+1