1-[(3S)-3-methylpiperidin-1-yl]-2-piperidin-1-ium-4-yl-ethanone

Systemtic Name: 1-[(3S)-3-methylpiperidin-1-yl]-2-piperidin-1-ium-4-yl-ethanone Openeye Name: 1-[(3S)-3-methyl-1-piperidyl]-2-piperidin-1-ium-4-yl-ethanone CAS Name: 1-[(3S)-3-methyl-1-piperidinyl]-2-(4-piperidin-1-iumyl)ethanone IUPAC Name: 1-[(3S)-3-methylpiperidin-1-yl]-2-piperidin-1-ium-4-ylethanone Traditional Name: 1-[(3S)-3-methylpiperidino]-2-piperidin-1-ium-4-yl-ethanone Formula: C13H25N2O+ MolecularWeight: 225.3504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CC2CC[NH2+]CC2

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CC2CC[NH2+]CC2

InChI

InChI=1S/C13H24N2O/c1-11-3-2-8-15(10-11)13(16)9-12-4-6-14-7-5-12/h11-12,14H,2-10H2,1H3/p+1/t11-/m0/s1