6-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N-methyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N-methyl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N-methyl-pyridin-1-ium-3-sulfonamide CAS Name: 6-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-N-methyl-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N-methylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N-methyl-pyridin-1-ium-3-sulfonamide Formula: C12H22N4O3S+2 MolecularWeight: 302.39308

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C[NH+]=C(C=C1)N2CC[NH+](CC2)CCO

Isomeric SMILES

CNS(=O)(=O)C1=C[NH+]=C(C=C1)N2CC[NH+](CC2)CCO

InChI

InChI=1S/C12H20N4O3S/c1-13-20(18,19)11-2-3-12(14-10-11)16-6-4-15(5-7-16)8-9-17/h2-3,10,13,17H,4-9H2,1H3/p+2