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

Systemtic Name: ethyl 1-(4-methoxyphenyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate tetrafluoroborate Openeye Name: ethyl 1-(4-methoxyphenyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylate tetrafluoroborate CAS Name: 1-(4-methoxyphenyl)-4,6-diphenyl-2-pyridin-1-iumcarboxylic acid ethyl ester tetrafluoroborate IUPAC Name: ethyl 1-(4-methoxyphenyl)-4,6-diphenylpyridin-1-ium-2-carboxylate tetrafluoroborate Traditional Name: 1-(4-methoxyphenyl)-4,6-diphenyl-pyridin-1-ium-2-carboxylic acid ethyl ester tetrafluoroborate Formula: C27H24BF4NO3 MolecularWeight: 497.288973

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCOC(=O)C1=CC(=CC(=[N+]1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CCOC(=O)C1=CC(=CC(=[N+]1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H24NO3.BF4/c1-3-31-27(29)26-19-22(20-10-6-4-7-11-20)18-25(21-12-8-5-9-13-21)28(26)23-14-16-24(30-2)17-15-23;2-1(3,4)5/h4-19H,3H2,1-2H3;/q+1;-1