1-[4-(2,6-diphenylphenoxy)butyl]-1-methyl-piperidin-1-ium tetrafluoroborate

Systemtic Name: 1-[4-(2,6-diphenylphenoxy)butyl]-1-methyl-piperidin-1-ium tetrafluoroborate Openeye Name: 1-[4-(2,6-diphenylphenoxy)butyl]-1-methyl-piperidin-1-ium tetrafluoroborate CAS Name: 1-[4-(2,6-diphenylphenoxy)butyl]-1-methylpiperidin-1-ium tetrafluoroborate IUPAC Name: 1-[4-(2,6-diphenylphenoxy)butyl]-1-methylpiperidin-1-ium tetrafluoroborate Traditional Name: 1-[4-(2,6-diphenylphenoxy)butyl]-1-methyl-piperidin-1-ium tetrafluoroborate Formula: C28H34BF4NO MolecularWeight: 487.380273

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1(CCCCC1)CCCCOC2=C(C=CC=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1(CCCCC1)CCCCOC2=C(C=CC=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H34NO.BF4/c1-29(20-9-4-10-21-29)22-11-12-23-30-28-26(24-14-5-2-6-15-24)18-13-19-27(28)25-16-7-3-8-17-25;2-1(3,4)5/h2-3,5-8,13-19H,4,9-12,20-23H2,1H3;/q+1;-1