[(2S)-3-methyl-1-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]butan-2-yl]azanium

Systemtic Name: [(2S)-3-methyl-1-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]butan-2-yl]azanium Openeye Name: [(1S)-2-methyl-1-[[methyl-(1-methylpiperidin-1-ium-4-yl)amino]methyl]propyl]ammonium CAS Name: [(2S)-3-methyl-1-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]butan-2-yl]ammonium IUPAC Name: [(2S)-3-methyl-1-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]butan-2-yl]azanium Traditional Name: [(1S)-2-methyl-1-[[methyl-(1-methylpiperidin-1-ium-4-yl)amino]methyl]propyl]ammonium Formula: C12H29N3+2 MolecularWeight: 215.37876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN(C)C1CC[NH+](CC1)C)[NH3+]

Isomeric SMILES

CC(C)[C@@H](CN(C)C1CC[NH+](CC1)C)[NH3+]

InChI

InChI=1S/C12H27N3/c1-10(2)12(13)9-15(4)11-5-7-14(3)8-6-11/h10-12H,5-9,13H2,1-4H3/p+2/t12-/m1/s1