3-[8-[2-(2-methoxyethoxy)ethyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenyl-propanenitrile

Systemtic Name: 3-[8-[2-(2-methoxyethoxy)ethyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenyl-propanenitrile Openeye Name: 3-[8-[2-(2-methoxyethoxy)ethyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenyl-propanenitrile CAS Name: 3-[8-[2-(2-methoxyethoxy)ethyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenylpropanenitrile IUPAC Name: 3-[8-[2-(2-methoxyethoxy)ethyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenylpropanenitrile Traditional Name: 3-[8-[2-(2-methoxyethoxy)ethyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenyl-propionitrile Formula: C28H37N2O2+ MolecularWeight: 433.60558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCC1CC(C2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)CCOCCOC

Isomeric SMILES

C[N+]1(C2CCC1CC(C2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)CCOCCOC

InChI

InChI=1S/C28H37N2O2/c1-30(15-16-32-18-17-31-2)26-13-14-27(30)20-23(19-26)21-28(22-29,24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-12,23,26-27H,13-21H2,1-2H3/q+1