1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-piperidin-1-ium-4-yl-ethanone

Systemtic Name: 1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-piperidin-1-ium-4-yl-ethanone Openeye Name: 1-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-piperidin-1-ium-4-yl-ethanone CAS Name: 1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-2-(4-piperidin-1-iumyl)ethanone IUPAC Name: 1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-piperidin-1-ium-4-ylethanone Traditional Name: 1-[(3S,5S)-3,5-dimethylpiperidino]-2-piperidin-1-ium-4-yl-ethanone Formula: C14H27N2O+ MolecularWeight: 239.37698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CC2CC[NH2+]CC2)C

Isomeric SMILES

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

InChI

InChI=1S/C14H26N2O/c1-11-7-12(2)10-16(9-11)14(17)8-13-3-5-15-6-4-13/h11-13,15H,3-10H2,1-2H3/p+1/t11-,12-/m0/s1