2-phenyl-5-pyridin-1-ium-1-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hexafluorophosphate

Systemtic Name: 2-phenyl-5-pyridin-1-ium-1-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hexafluorophosphate Openeye Name: 2-phenyl-5-pyridin-1-ium-1-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hexafluorophosphate CAS Name: 2-phenyl-5-(1-pyridin-1-iumyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione hexafluorophosphate IUPAC Name: 2-phenyl-5-pyridin-1-ium-1-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hexafluorophosphate Traditional Name: 2-phenyl-5-pyridin-1-ium-1-yl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone hexafluorophosphate Formula: C19H17F6N2O2P MolecularWeight: 450.31466

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC2C1C(=O)N(C2=O)C3=CC=CC=C3)[N+]4=CC=CC=C4.F[P-](F)(F)(F)(F)F

Isomeric SMILES

C1C=C(CC2C1C(=O)N(C2=O)C3=CC=CC=C3)[N+]4=CC=CC=C4.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C19H17N2O2.F6P/c22-18-16-10-9-15(20-11-5-2-6-12-20)13-17(16)19(23)21(18)14-7-3-1-4-8-14;1-7(2,3,4,5)6/h1-9,11-12,16-17H,10,13H2;/q+1;-1