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

Systemtic Name: [3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxo-propyl]ammonium CAS Name: [3-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-3-oxopropyl]ammonium IUPAC Name: [3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]propyl]ammonium Formula: C12H27N3O+2 MolecularWeight: 229.36228

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)CC[NH3+]

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)CC[NH3+]

InChI

InChI=1S/C12H25N3O/c1-11-5-2-3-9-15(11)10-4-8-14-12(16)6-7-13/h11H,2-10,13H2,1H3,(H,14,16)/p+2/t11-/m0/s1