3-[(3-oxidanylidene-1-azabicyclo[2.2.2]octan-2-yl)methyl]pentane-2,4-dione

Systemtic Name: 3-[(3-oxidanylidene-1-azabicyclo[2.2.2]octan-2-yl)methyl]pentane-2,4-dione Openeye Name: 3-[(3-oxoquinuclidin-2-yl)methyl]pentane-2,4-dione CAS Name: 3-[(3-oxo-1-azabicyclo[2.2.2]octan-2-yl)methyl]pentane-2,4-dione IUPAC Name: 3-[(3-oxo-1-azabicyclo[2.2.2]octan-2-yl)methyl]pentane-2,4-dione Traditional Name: 3-[(3-ketoquinuclidin-2-yl)methyl]pentane-2,4-dione Formula: C13H19NO3 MolecularWeight: 237.29486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO3/c1-8(15)11(9(2)16)7-12-13(17)10-3-5-14(12)6-4-10/h10-12H,3-7H2,1-2H3