[1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide

Systemtic Name: [1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide Openeye Name: [1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide CAS Name: [1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenylmethanol bromide IUPAC Name: [1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenylmethanol bromide Traditional Name: [1-(2-phenoxyethyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol bromide Formula: C27H30BrNO2 MolecularWeight: 480.4366

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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)CCOC5=CC=CC=C5.[Br-]

Isomeric SMILES

C1C[N+]2(CCC1(C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CCOC5=CC=CC=C5.[Br-]

InChI

InChI=1S/C27H30NO2.BrH/c29-27(23-10-4-1-5-11-23,24-12-6-2-7-13-24)26-16-18-28(22-26,19-17-26)20-21-30-25-14-8-3-9-15-25;/h1-15,29H,16-22H2;1H/q+1;/p-1