[2-(5-bicyclo[2.2.1]hept-2-enyl)-4-methyl-chromen-7-ylidene]-diethyl-azanium tetrafluoroborate

Systemtic Name: [2-(5-bicyclo[2.2.1]hept-2-enyl)-4-methyl-chromen-7-ylidene]-diethyl-azanium tetrafluoroborate Openeye Name: [2-(5-bicyclo[2.2.1]hept-2-enyl)-4-methyl-chromen-7-ylidene]-diethyl-ammonium tetrafluoroborate CAS Name: [2-(5-bicyclo[2.2.1]hept-2-enyl)-4-methyl-1-benzopyran-7-ylidene]-diethylammonium tetrafluoroborate IUPAC Name: [2-(5-bicyclo[2.2.1]hept-2-enyl)-4-methylchromen-7-ylidene]-diethylazanium tetrafluoroborate Traditional Name: [2-(5-bicyclo[2.2.1]hept-2-enyl)-4-methyl-chromen-7-ylidene]-diethyl-ammonium tetrafluoroborate Formula: C21H26BF4NO MolecularWeight: 395.241853

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC[N+](=C1C=CC2=C(C=C(OC2=C1)C3CC4CC3C=C4)C)CC

Isomeric SMILES

[B-](F)(F)(F)F.CC[N+](=C1C=CC2=C(C=C(OC2=C1)C3CC4CC3C=C4)C)CC

InChI

InChI=1S/C21H26NO.BF4/c1-4-22(5-2)17-8-9-18-14(3)10-20(23-21(18)13-17)19-12-15-6-7-16(19)11-15;2-1(3,4)5/h6-10,13,15-16,19H,4-5,11-12H2,1-3H3;/q+1;-1