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

Systemtic Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-pyridin-1-ium-3-sulfonamide Openeye Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-pyridin-1-ium-3-sulfonamide CAS Name: 2-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-N,N-dimethyl-3-pyridin-1-iumsulfonamide IUPAC Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethylpyridin-1-ium-3-sulfonamide Traditional Name: 2-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-N,N-dimethyl-pyridin-1-ium-3-sulfonamide Formula: C13H24N4O3S+2 MolecularWeight: 316.41966

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C([NH+]=CC=C1)N2CC[NH+](CC2)CCO

Isomeric SMILES

CN(C)S(=O)(=O)C1=C([NH+]=CC=C1)N2CC[NH+](CC2)CCO

InChI

InChI=1S/C13H22N4O3S/c1-15(2)21(19,20)12-4-3-5-14-13(12)17-8-6-16(7-9-17)10-11-18/h3-5,18H,6-11H2,1-2H3/p+2