1-(azepan-1-yl)-2-piperidin-1-ium-4-yl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-piperidin-1-ium-4-yl-ethanone Openeye Name: 1-(azepan-1-yl)-2-piperidin-1-ium-4-yl-ethanone CAS Name: 1-(1-azepanyl)-2-(4-piperidin-1-iumyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-piperidin-1-ium-4-ylethanone Traditional Name: 1-(azepan-1-yl)-2-piperidin-1-ium-4-yl-ethanone Formula: C13H25N2O+ MolecularWeight: 225.3504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC2CC[NH2+]CC2

Isomeric SMILES

C1CCCN(CC1)C(=O)CC2CC[NH2+]CC2

InChI

InChI=1S/C13H24N2O/c16-13(11-12-5-7-14-8-6-12)15-9-3-1-2-4-10-15/h12,14H,1-11H2/p+1