2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-(4-besylpiperazin-1-ium-1-yl)ethanol Formula: C12H19N2O3S+ MolecularWeight: 271.35586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH+]1CCO)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H18N2O3S/c15-11-10-13-6-8-14(9-7-13)18(16,17)12-4-2-1-3-5-12/h1-5,15H,6-11H2/p+1