dimethyl-[3-[methyl-[(3S)-1-methylsulfonylpiperidin-3-yl]azaniumyl]propyl]azanium

Systemtic Name: dimethyl-[3-[methyl-[(3S)-1-methylsulfonylpiperidin-3-yl]azaniumyl]propyl]azanium Openeye Name: dimethyl-[3-[methyl-[(3S)-1-methylsulfonyl-3-piperidyl]ammonio]propyl]ammonium CAS Name: dimethyl-[3-[methyl-[(3S)-1-methylsulfonyl-3-piperidinyl]ammonio]propyl]ammonium IUPAC Name: dimethyl-[3-[methyl-[(3S)-1-methylsulfonylpiperidin-3-yl]azaniumyl]propyl]azanium Traditional Name: 3-(dimethylammonio)propyl-[(3S)-1-mesyl-3-piperidyl]-methyl-ammonium Formula: C12H29N3O2S+2 MolecularWeight: 279.44256

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH+](C)C1CCCN(C1)S(=O)(=O)C

Isomeric SMILES

C[NH+](C)CCC[NH+](C)[C@H]1CCCN(C1)S(=O)(=O)C

InChI

InChI=1S/C12H27N3O2S/c1-13(2)8-6-9-14(3)12-7-5-10-15(11-12)18(4,16)17/h12H,5-11H2,1-4H3/p+2/t12-/m0/s1