4-methylthianthren-10-ium 5,5-dioxide hexafluorophosphate

Systemtic Name: 4-methylthianthren-10-ium 5,5-dioxide hexafluorophosphate Openeye Name: 4-methylthianthren-10-ium 5,5-dioxide hexafluorophosphate CAS Name: 4-methylthianthren-10-ium 5,5-dioxide hexafluorophosphate IUPAC Name: 4-methylthianthren-10-ium 5,5-dioxide hexafluorophosphate Traditional Name: 4-methylthianthren-10-ium 5,5-dioxide hexafluorophosphate Formula: C13H11F6O2PS2 MolecularWeight: 408.31942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)[SH+]C3=CC=CC=C3S2(=O)=O.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC1=C2C(=CC=C1)[SH+]C3=CC=CC=C3S2(=O)=O.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C13H10O2S2.F6P/c1-9-5-4-7-11-13(9)17(14,15)12-8-3-2-6-10(12)16-11;1-7(2,3,4,5)6/h2-8H,1H3;/q;-1/p+1