1-[4-(azepan-1-ium-1-yl)piperidin-1-yl]ethanone

Systemtic Name: 1-[4-(azepan-1-ium-1-yl)piperidin-1-yl]ethanone Openeye Name: 1-[4-(azepan-1-ium-1-yl)-1-piperidyl]ethanone CAS Name: 1-[4-(1-azepan-1-iumyl)-1-piperidinyl]ethanone IUPAC Name: 1-[4-(azepan-1-ium-1-yl)piperidin-1-yl]ethanone Traditional Name: 1-[4-(azepan-1-ium-1-yl)piperidino]ethanone Formula: C13H25N2O+ MolecularWeight: 225.3504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)[NH+]2CCCCCC2

Isomeric SMILES

CC(=O)N1CCC(CC1)[NH+]2CCCCCC2

InChI

InChI=1S/C13H24N2O/c1-12(16)14-10-6-13(7-11-14)15-8-4-2-3-5-9-15/h13H,2-11H2,1H3/p+1