10-[(E)-4-methylpent-2-en-2-yl]phenoxathiin-10-ium hexafluorophosphate

Systemtic Name: 10-[(E)-4-methylpent-2-en-2-yl]phenoxathiin-10-ium hexafluorophosphate Openeye Name: 10-[(E)-1,3-dimethylbut-1-enyl]phenoxathiin-10-ium hexafluorophosphate CAS Name: 10-[(E)-4-methylpent-2-en-2-yl]phenoxathiin-10-ium hexafluorophosphate IUPAC Name: 10-[(E)-4-methylpent-2-en-2-yl]phenoxathiin-10-ium hexafluorophosphate Traditional Name: 10-[(E)-1,3-dimethylbut-1-enyl]phenoxathiin-10-ium hexafluorophosphate Formula: C18H19F6OPS MolecularWeight: 428.37204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=C(C)[S+]1C2=CC=CC=C2OC3=CC=CC=C31.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CC(C)/C=C(\C)/[S+]1C2=CC=CC=C2OC3=CC=CC=C31.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C18H19OS.F6P/c1-13(2)12-14(3)20-17-10-6-4-8-15(17)19-16-9-5-7-11-18(16)20;1-7(2,3,4,5)6/h4-13H,1-3H3;/q+1;-1/b14-12+;