2-phenyl-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one

Systemtic Name: 2-phenyl-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one Openeye Name: 1-benzyl-2-phenyl-quinuclidin-1-ium-3-one CAS Name: 2-phenyl-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one IUPAC Name: 1-benzyl-2-phenyl-1-azoniabicyclo[2.2.2]octan-3-one Traditional Name: 1-benzyl-2-phenyl-quinuclidin-1-ium-3-one Formula: C20H22NO+ MolecularWeight: 292.39478

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1C(=O)C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[N+]2(CCC1C(=O)C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22NO/c22-20-18-11-13-21(14-12-18,15-16-7-3-1-4-8-16)19(20)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2/q+1