5-non-1-ynylthianthren-5-ium tetrafluoroborate

Systemtic Name: 5-non-1-ynylthianthren-5-ium tetrafluoroborate Openeye Name: 5-non-1-ynylthianthren-5-ium tetrafluoroborate CAS Name: 5-non-1-ynylthianthren-5-ium tetrafluoroborate IUPAC Name: 5-non-1-ynylthianthren-5-ium tetrafluoroborate Traditional Name: 5-non-1-ynylthianthren-5-ium tetrafluoroborate Formula: C21H23BF4S2 MolecularWeight: 426.341933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23S2.BF4/c1-2-3-4-5-6-7-12-17-23-20-15-10-8-13-18(20)22-19-14-9-11-16-21(19)23;2-1(3,4)5/h8-11,13-16H,2-7H2,1H3;/q+1;-1