2-ethyl-1H-isothiochromen-2-ium-4-one tetrafluoroborate

Systemtic Name: 2-ethyl-1H-isothiochromen-2-ium-4-one tetrafluoroborate Openeye Name: 2-ethylisothiochroman-2-ium-4-one tetrafluoroborate CAS Name: 2-ethyl-1H-2-benzothiopyran-2-ium-4-one tetrafluoroborate IUPAC Name: 2-ethyl-1H-isothiochromen-2-ium-4-one tetrafluoroborate Traditional Name: 2-ethylisothiochroman-2-ium-4-one tetrafluoroborate Formula: C11H13BF4OS MolecularWeight: 280.089933

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC[S+]1CC2=CC=CC=C2C(=O)C1

Isomeric SMILES

[B-](F)(F)(F)F.CC[S+]1CC2=CC=CC=C2C(=O)C1

InChI

InChI=1S/C11H13OS.BF4/c1-2-13-7-9-5-3-4-6-10(9)11(12)8-13;2-1(3,4)5/h3-6H,2,7-8H2,1H3;/q+1;-1