5-pent-1-ynylthianthren-5-ium tetrafluoroborate

Systemtic Name: 5-pent-1-ynylthianthren-5-ium tetrafluoroborate Openeye Name: 5-pent-1-ynylthianthren-5-ium tetrafluoroborate CAS Name: 5-pent-1-ynylthianthren-5-ium tetrafluoroborate IUPAC Name: 5-pent-1-ynylthianthren-5-ium tetrafluoroborate Traditional Name: 5-pent-1-ynylthianthren-5-ium tetrafluoroborate Formula: C17H15BF4S2 MolecularWeight: 370.235613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15S2.BF4/c1-2-3-8-13-19-16-11-6-4-9-14(16)18-15-10-5-7-12-17(15)19;2-1(3,4)5/h4-7,9-12H,2-3H2,1H3;/q+1;-1