benzenesulfonate; 2-[3-[2-(2-hydroxyethyloxy)ethyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol

Systemtic Name: benzenesulfonate; 2-[3-[2-(2-hydroxyethyloxy)ethyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol Openeye Name: benzenesulfonate; 2-[3-[2-(2-hydroxyethoxy)ethyl]-4-methyl-thiazol-3-ium-5-yl]ethanol CAS Name: benzenesulfonate; 2-[3-[2-(2-hydroxyethoxy)ethyl]-4-methyl-5-thiazol-3-iumyl]ethanol IUPAC Name: benzenesulfonate; 2-[3-[2-(2-hydroxyethoxy)ethyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol Traditional Name: 2-[3-[2-(2-hydroxyethoxy)ethyl]-4-methyl-thiazol-3-ium-5-yl]ethanol besylate Formula: C16H23NO6S2 MolecularWeight: 389.48692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CCOCCO)CCO.C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC1=C(SC=[N+]1CCOCCO)CCO.C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C10H18NO3S.C6H6O3S/c1-9-10(2-4-12)15-8-11(9)3-6-14-7-5-13;7-10(8,9)6-4-2-1-3-5-6/h8,12-13H,2-7H2,1H3;1-5H,(H,7,8,9)/q+1;/p-1