1-(1,4-diazabicyclo[2.2.2]octan-3-ylmethoxy)-3-isocyano-propan-2-one

Systemtic Name: 1-(1,4-diazabicyclo[2.2.2]octan-3-ylmethoxy)-3-isocyano-propan-2-one Openeye Name: 1-(1,4-diazabicyclo[2.2.2]octan-3-ylmethoxy)-3-isocyano-propan-2-one CAS Name: 1-(1,4-diazabicyclo[2.2.2]octan-3-ylmethoxy)-3-isocyano-2-propanone IUPAC Name: 1-(1,4-diazabicyclo[2.2.2]octan-3-ylmethoxy)-3-isocyanopropan-2-one Traditional Name: 1-(1,4-diazabicyclo[2.2.2]octan-3-ylmethoxy)-3-isocyano-acetone Formula: C11H17N3O2 MolecularWeight: 223.27158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]CC(=O)COCC1CN2CCN1CC2

Isomeric SMILES

[C-]#[N+]CC(=O)COCC1CN2CCN1CC2

InChI

InChI=1S/C11H17N3O2/c1-12-6-11(15)9-16-8-10-7-13-2-4-14(10)5-3-13/h10H,2-9H2