2-[(3-oxidanylidene-1-azabicyclo[2.2.2]octan-2-yl)methyl]-1-phenyl-butane-1,3-dione

Systemtic Name: 2-[(3-oxidanylidene-1-azabicyclo[2.2.2]octan-2-yl)methyl]-1-phenyl-butane-1,3-dione Openeye Name: 2-[(3-oxoquinuclidin-2-yl)methyl]-1-phenyl-butane-1,3-dione CAS Name: 2-[(3-oxo-1-azabicyclo[2.2.2]octan-2-yl)methyl]-1-phenylbutane-1,3-dione IUPAC Name: 2-[(3-oxo-1-azabicyclo[2.2.2]octan-2-yl)methyl]-1-phenylbutane-1,3-dione Traditional Name: 2-[(3-ketoquinuclidin-2-yl)methyl]-1-phenyl-butane-1,3-dione Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1C(=O)C2CCN1CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C(CC1C(=O)C2CCN1CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21NO3/c1-12(20)15(17(21)13-5-3-2-4-6-13)11-16-18(22)14-7-9-19(16)10-8-14/h2-6,14-16H,7-11H2,1H3