1-[(2R,6R)-1-methyl-6-(2-oxidanylidenebutyl)piperidin-1-ium-2-yl]butan-2-one

Systemtic Name: 1-[(2R,6R)-1-methyl-6-(2-oxidanylidenebutyl)piperidin-1-ium-2-yl]butan-2-one Openeye Name: 1-[(2R,6R)-1-methyl-6-(2-oxobutyl)piperidin-1-ium-2-yl]butan-2-one CAS Name: 1-[(2R,6R)-1-methyl-6-(2-oxobutyl)-2-piperidin-1-iumyl]-2-butanone IUPAC Name: 1-[(2R,6R)-1-methyl-6-(2-oxobutyl)piperidin-1-ium-2-yl]butan-2-one Traditional Name: 1-[(2R,6R)-6-(2-ketobutyl)-1-methyl-piperidin-1-ium-2-yl]butan-2-one Formula: C14H26NO2+ MolecularWeight: 240.36174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1CCCC([NH+]1C)CC(=O)CC

Isomeric SMILES

CCC(=O)C[C@H]1CCC[C@@H]([NH+]1C)CC(=O)CC

InChI

InChI=1S/C14H25NO2/c1-4-13(16)9-11-7-6-8-12(15(11)3)10-14(17)5-2/h11-12H,4-10H2,1-3H3/p+1/t11-,12-/m1/s1