[4-(azaniumylmethyl)-1-methyl-piperidin-1-ium-4-yl]-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide

Systemtic Name: [4-(azaniumylmethyl)-1-methyl-piperidin-1-ium-4-yl]-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide Openeye Name: [4-(azaniumylmethyl)-1-methyl-piperidin-1-ium-4-yl]-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide CAS Name: [4-(ammoniomethyl)-1-methyl-4-piperidin-1-iumyl]-[[(2S)-2-methyl-1-piperidin-1-iumyl]sulfonyl]azanide IUPAC Name: [4-(azaniumylmethyl)-1-methylpiperidin-1-ium-4-yl]-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonylazanide Traditional Name: [4-(ammoniomethyl)-1-methyl-piperidin-1-ium-4-yl]-[(2S)-2-methylpiperidin-1-ium-1-yl]sulfonyl-azanide Formula: C13H30N4O2S+2 MolecularWeight: 306.4679

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1S(=O)(=O)[N-]C2(CC[NH+](CC2)C)C[NH3+]

Isomeric SMILES

C[C@H]1CCCC[NH+]1S(=O)(=O)[N-]C2(CC[NH+](CC2)C)C[NH3+]

InChI

InChI=1S/C13H27N4O2S/c1-12-5-3-4-8-17(12)20(18,19)15-13(11-14)6-9-16(2)10-7-13/h12H,3-11,14H2,1-2H3/q-1/p+3/t12-/m0/s1