2-(4-ethylphenyl)-6,8-dimethoxy-1,3-dimethyl-isoquinolin-2-ium tetrafluoroborate

Systemtic Name: 2-(4-ethylphenyl)-6,8-dimethoxy-1,3-dimethyl-isoquinolin-2-ium tetrafluoroborate Openeye Name: 2-(4-ethylphenyl)-6,8-dimethoxy-1,3-dimethyl-isoquinolin-2-ium tetrafluoroborate CAS Name: 2-(4-ethylphenyl)-6,8-dimethoxy-1,3-dimethylisoquinolin-2-ium tetrafluoroborate IUPAC Name: 2-(4-ethylphenyl)-6,8-dimethoxy-1,3-dimethylisoquinolin-2-ium tetrafluoroborate Traditional Name: 2-(4-ethylphenyl)-6,8-dimethoxy-1,3-dimethyl-isoquinolin-2-ium tetrafluoroborate Formula: C21H24BF4NO2 MolecularWeight: 409.225373

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCC1=CC=C(C=C1)[N+]2=C(C3=C(C=C(C=C3C=C2C)OC)OC)C

Isomeric SMILES

[B-](F)(F)(F)F.CCC1=CC=C(C=C1)[N+]2=C(C3=C(C=C(C=C3C=C2C)OC)OC)C

InChI

InChI=1S/C21H24NO2.BF4/c1-6-16-7-9-18(10-8-16)22-14(2)11-17-12-19(23-4)13-20(24-5)21(17)15(22)3;2-1(3,4)5/h7-13H,6H2,1-5H3;/q+1;-1