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

Systemtic Name: [1-(cyclohexylmethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide Openeye Name: [1-(cyclohexylmethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide CAS Name: [1-(cyclohexylmethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenylmethanol bromide IUPAC Name: [1-(cyclohexylmethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenylmethanol bromide Traditional Name: [1-(cyclohexylmethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide Formula: C26H34BrNO MolecularWeight: 456.45826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[N+]23CCC(C2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O.[Br-]

Isomeric SMILES

C1CCC(CC1)C[N+]23CCC(C2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O.[Br-]

InChI

InChI=1S/C26H34NO.BrH/c28-26(23-12-6-2-7-13-23,24-14-8-3-9-15-24)25-16-18-27(21-25,19-17-25)20-22-10-4-1-5-11-22;/h2-3,6-9,12-15,22,28H,1,4-5,10-11,16-21H2;1H/q+1;/p-1