bis(4-methylphenyl)-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanium hexafluorophosphate

Systemtic Name: bis(4-methylphenyl)-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanium hexafluorophosphate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl]-bis(p-tolyl)sulfonium hexafluorophosphate CAS Name: bis(4-methylphenyl)-[2-(4-nitrophenyl)-2-oxoethyl]sulfonium hexafluorophosphate IUPAC Name: bis(4-methylphenyl)-[2-(4-nitrophenyl)-2-oxoethyl]sulfanium hexafluorophosphate Traditional Name: [2-keto-2-(4-nitrophenyl)ethyl]-bis(p-tolyl)sulfonium hexafluorophosphate Formula: C22H20F6NO3PS MolecularWeight: 523.42828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[S+](CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)C.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)[S+](CC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)C.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C22H20NO3S.F6P/c1-16-3-11-20(12-4-16)27(21-13-5-17(2)6-14-21)15-22(24)18-7-9-19(10-8-18)23(25)26;1-7(2,3,4,5)6/h3-14H,15H2,1-2H3;/q+1;-1