(2S)-1-(4-methylpiperidin-1-yl)-2-piperidin-1-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-(4-methylpiperidin-1-yl)-2-piperidin-1-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(4-methyl-1-piperidyl)-2-piperidin-1-ium-1-yl-propan-1-one CAS Name: (2S)-1-(4-methyl-1-piperidinyl)-2-(1-piperidin-1-iumyl)-1-propanone IUPAC Name: (2S)-1-(4-methylpiperidin-1-yl)-2-piperidin-1-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(4-methylpiperidino)-2-piperidin-1-ium-1-yl-propan-1-one Formula: C14H27N2O+ MolecularWeight: 239.37698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)[NH+]2CCCCC2

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](C)[NH+]2CCCCC2

InChI

InChI=1S/C14H26N2O/c1-12-6-10-16(11-7-12)14(17)13(2)15-8-4-3-5-9-15/h12-13H,3-11H2,1-2H3/p+1/t13-/m0/s1