dimethyl-[3-[[(2S)-1-[(2S)-2-methylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]azaniumyl]propyl]azanium

Systemtic Name: dimethyl-[3-[[(2S)-1-[(2S)-2-methylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]azaniumyl]propyl]azanium Openeye Name: dimethyl-[3-[[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]ammonio]propyl]ammonium CAS Name: dimethyl-[3-[[(2S)-1-[(2S)-2-methyl-1-piperidinyl]-1-oxopropan-2-yl]ammonio]propyl]ammonium IUPAC Name: dimethyl-[3-[[(2S)-1-[(2S)-2-methylpiperidin-1-yl]-1-oxopropan-2-yl]azaniumyl]propyl]azanium Traditional Name: 3-[[(1S)-2-keto-1-methyl-2-[(2S)-2-methylpiperidino]ethyl]ammonio]propyl-dimethyl-ammonium Formula: C14H31N3O+2 MolecularWeight: 257.41544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C(C)[NH2+]CCC[NH+](C)C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)[C@H](C)[NH2+]CCC[NH+](C)C

InChI

InChI=1S/C14H29N3O/c1-12-8-5-6-11-17(12)14(18)13(2)15-9-7-10-16(3)4/h12-13,15H,5-11H2,1-4H3/p+2/t12-,13-/m0/s1