2-ethyl-4H-1,2-benzoxazol-2-ium-7-one tritetrafluoroborate

Systemtic Name: 2-ethyl-4H-1,2-benzoxazol-2-ium-7-one tritetrafluoroborate Openeye Name: 2-ethyl-4H-1,2-benzoxazol-2-ium-7-one tritetrafluoroborate CAS Name: 2-ethyl-4H-1,2-benzoxazol-2-ium-7-one tritetrafluoroborate IUPAC Name: 2-ethyl-4H-1,2-benzoxazol-2-ium-7-one tritetrafluoroborate Traditional Name: 2-ethyl-4H-indoxazen-2-ium-7-one tritetrafluoroborate Formula: C9H10B3F12NO2-2 MolecularWeight: 424.595038

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC[N+]1=CC2=C(O1)C(=O)C=CC2

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC[N+]1=CC2=C(O1)C(=O)C=CC2

InChI

InChI=1S/C9H10NO2.3BF4/c1-2-10-6-7-4-3-5-8(11)9(7)12-10;3*2-1(3,4)5/h3,5-6H,2,4H2,1H3;;;/q+1;3*-1