ethyl 1-(dimethylamino)-4,6-diphenyl-pyridin-1-ium-2-carboxylate tetrafluoroborate

Systemtic Name: ethyl 1-(dimethylamino)-4,6-diphenyl-pyridin-1-ium-2-carboxylate tetrafluoroborate Openeye Name: ethyl 1-(dimethylamino)-4,6-diphenyl-pyridin-1-ium-2-carboxylate tetrafluoroborate CAS Name: 1-(dimethylamino)-4,6-diphenyl-2-pyridin-1-iumcarboxylic acid ethyl ester tetrafluoroborate IUPAC Name: ethyl 1-(dimethylamino)-4,6-diphenylpyridin-1-ium-2-carboxylate tetrafluoroborate Traditional Name: 1-(dimethylamino)-4,6-diphenyl-pyridin-1-ium-2-carboxylic acid ethyl ester tetrafluoroborate Formula: C22H23BF4N2O2 MolecularWeight: 434.234833

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCOC(=O)C1=CC(=CC(=[N+]1N(C)C)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[B-](F)(F)(F)F.CCOC(=O)C1=CC(=CC(=[N+]1N(C)C)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N2O2.BF4/c1-4-26-22(25)21-16-19(17-11-7-5-8-12-17)15-20(24(21)23(2)3)18-13-9-6-10-14-18;2-1(3,4)5/h5-16H,4H2,1-3H3;/q+1;-1