[2-(dimethylamino)-2-oxidanylidene-ethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Openeye Name: [2-(dimethylamino)-2-oxo-ethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium CAS Name: [2-(dimethylamino)-2-oxoethyl]-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]ammonium IUPAC Name: [2-(dimethylamino)-2-oxoethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Traditional Name: [2-(dimethylamino)-2-keto-ethyl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium Formula: C13H29N3O+2 MolecularWeight: 243.38886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]CC(=O)N(C)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+]CC(=O)N(C)C

InChI

InChI=1S/C13H27N3O/c1-12-7-4-5-9-16(12)10-6-8-14-11-13(17)15(2)3/h12,14H,4-11H2,1-3H3/p+2/t12-/m0/s1