2-[4-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-[3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridin-1-iumyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-[3-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]piperazin-1-ium-1-yl]ethanol Formula: C16H30N5O3S+3 MolecularWeight: 372.5061

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=C([NH+]=CC=C2)N3CC[NH+](CC3)CCO

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=C([NH+]=CC=C2)N3CC[NH+](CC3)CCO

InChI

InChI=1S/C16H27N5O3S/c1-18-5-11-21(12-6-18)25(23,24)15-3-2-4-17-16(15)20-9-7-19(8-10-20)13-14-22/h2-4,22H,5-14H2,1H3/p+3