1-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-1-azoniabicyclo[2.2.2]octan-3-one

Systemtic Name: 1-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-1-azoniabicyclo[2.2.2]octan-3-one Openeye Name: 1-[2-(1-adamantyl)-2-oxo-ethyl]quinuclidin-1-ium-3-one CAS Name: 1-[2-(1-adamantyl)-2-oxoethyl]-1-azoniabicyclo[2.2.2]octan-3-one IUPAC Name: 1-[2-(1-adamantyl)-2-oxoethyl]-1-azoniabicyclo[2.2.2]octan-3-one Traditional Name: 1-[2-(1-adamantyl)-2-keto-ethyl]quinuclidin-1-ium-3-one Formula: C19H28NO2+ MolecularWeight: 302.43112

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1C(=O)C2)CC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1C[N+]2(CCC1C(=O)C2)CC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C19H28NO2/c21-17-11-20(3-1-16(17)2-4-20)12-18(22)19-8-13-5-14(9-19)7-15(6-13)10-19/h13-16H,1-12H2/q+1