2-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-1-ol tetrafluoroborate

Systemtic Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-1-ol tetrafluoroborate Openeye Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-1-ol tetrafluoroborate CAS Name: 2-(2,4,6-triphenyl-1-pyridin-1-iumyl)-1-butanol tetrafluoroborate IUPAC Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-1-ol tetrafluoroborate Traditional Name: 2-(2,4,6-triphenylpyridin-1-ium-1-yl)butan-1-ol tetrafluoroborate Formula: C27H26BF4NO MolecularWeight: 467.306053

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCC(CO)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CCC(CO)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26NO.BF4/c1-2-25(20-29)28-26(22-14-8-4-9-15-22)18-24(21-12-6-3-7-13-21)19-27(28)23-16-10-5-11-17-23;2-1(3,4)5/h3-19,25,29H,2,20H2,1H3;/q+1;-1