2-(1-azabicyclo[2.2.2]octan-3-yl)-4-phenyl-1H-pyrazol-5-one

Systemtic Name: 2-(1-azabicyclo[2.2.2]octan-3-yl)-4-phenyl-1H-pyrazol-5-one Openeye Name: 4-phenyl-2-quinuclidin-3-yl-1H-pyrazol-5-one CAS Name: 2-(1-azabicyclo[2.2.2]octan-3-yl)-4-phenyl-1H-pyrazol-5-one IUPAC Name: 2-(1-azabicyclo[2.2.2]octan-3-yl)-4-phenyl-1H-pyrazol-5-one Traditional Name: 4-phenyl-1-quinuclidin-3-yl-3-pyrazolin-3-one Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)N3C=C(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

C1CN2CCC1C(C2)N3C=C(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C16H19N3O/c20-16-14(12-4-2-1-3-5-12)10-19(17-16)15-11-18-8-6-13(15)7-9-18/h1-5,10,13,15H,6-9,11H2,(H,17,20)