azepan-1-yl-(1-oxidanidylpyridin-1-ium-4-yl)methanone

Systemtic Name: azepan-1-yl-(1-oxidanidylpyridin-1-ium-4-yl)methanone Openeye Name: azepan-1-yl-(1-oxidopyridin-1-ium-4-yl)methanone CAS Name: 1-azepanyl-(1-oxido-4-pyridin-1-iumyl)methanone IUPAC Name: azepan-1-yl-(1-oxidopyridin-1-ium-4-yl)methanone Traditional Name: azepan-1-yl-(1-oxidopyridin-1-ium-4-yl)methanone Formula: C12H16N2O2 MolecularWeight: 220.26764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C12H16N2O2/c15-12(11-5-9-14(16)10-6-11)13-7-3-1-2-4-8-13/h5-6,9-10H,1-4,7-8H2