diphenyl-[1-(4-phenylbutyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]methanol bromide

Systemtic Name: diphenyl-[1-(4-phenylbutyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]methanol bromide Openeye Name: diphenyl-[1-(4-phenylbutyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]methanol bromide CAS Name: diphenyl-[1-(4-phenylbutyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]methanol bromide IUPAC Name: diphenyl-[1-(4-phenylbutyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]methanol bromide Traditional Name: diphenyl-[1-(4-phenylbutyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]methanol bromide Formula: C29H34BrNO MolecularWeight: 492.49036

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1(C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CCCCC5=CC=CC=C5.[Br-]

Isomeric SMILES

C1C[N+]2(CCC1(C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CCCCC5=CC=CC=C5.[Br-]

InChI

InChI=1S/C29H34NO.BrH/c31-29(26-15-6-2-7-16-26,27-17-8-3-9-18-27)28-19-22-30(24-28,23-20-28)21-11-10-14-25-12-4-1-5-13-25;/h1-9,12-13,15-18,31H,10-11,14,19-24H2;1H/q+1;/p-1