5-dec-1-ynylthianthren-5-ium tetrafluoroborate

Systemtic Name: 5-dec-1-ynylthianthren-5-ium tetrafluoroborate Openeye Name: 5-dec-1-ynylthianthren-5-ium tetrafluoroborate CAS Name: 5-dec-1-ynylthianthren-5-ium tetrafluoroborate IUPAC Name: 5-dec-1-ynylthianthren-5-ium tetrafluoroborate Traditional Name: 5-dec-1-ynylthianthren-5-ium tetrafluoroborate Formula: C22H25BF4S2 MolecularWeight: 440.368513

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCCCCCC#C[S+]1C2=CC=CC=C2SC3=CC=CC=C31

Isomeric SMILES

[B-](F)(F)(F)F.CCCCCCCCC#C[S+]1C2=CC=CC=C2SC3=CC=CC=C31

InChI

InChI=1S/C22H25S2.BF4/c1-2-3-4-5-6-7-8-13-18-24-21-16-11-9-14-19(21)23-20-15-10-12-17-22(20)24;2-1(3,4)5/h9-12,14-17H,2-8H2,1H3;/q+1;-1