1-(1-azabicyclo[2.2.2]octan-3-yl)-1-butyl-cinnolin-1-ium-4-one

Systemtic Name: 1-(1-azabicyclo[2.2.2]octan-3-yl)-1-butyl-cinnolin-1-ium-4-one Openeye Name: 1-butyl-1-quinuclidin-3-yl-cinnolin-1-ium-4-one CAS Name: 1-(1-azabicyclo[2.2.2]octan-3-yl)-1-butyl-4-cinnolin-1-iumone IUPAC Name: 1-(1-azabicyclo[2.2.2]octan-3-yl)-1-butylcinnolin-1-ium-4-one Traditional Name: 1-butyl-1-quinuclidin-3-yl-cinnolin-1-ium-4-one Formula: C19H26N3O+ MolecularWeight: 312.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C2=CC=CC=C2C(=O)C=N1)C3CN4CCC3CC4

Isomeric SMILES

CCCC[N+]1(C2=CC=CC=C2C(=O)C=N1)C3CN4CCC3CC4

InChI

InChI=1S/C19H26N3O/c1-2-3-12-22(18-14-21-10-8-15(18)9-11-21)17-7-5-4-6-16(17)19(23)13-20-22/h4-7,13,15,18H,2-3,8-12,14H2,1H3/q+1