benzenesulfonate; 3-(4-methylmorpholin-4-ium-4-yl)thiolane 1,1-dioxide

Systemtic Name: benzenesulfonate; 3-(4-methylmorpholin-4-ium-4-yl)thiolane 1,1-dioxide Openeye Name: benzenesulfonate; 3-(4-methylmorpholin-4-ium-4-yl)thiolane 1,1-dioxide CAS Name: benzenesulfonate; 3-(4-methyl-4-morpholin-4-iumyl)thiolane 1,1-dioxide IUPAC Name: benzenesulfonate; 3-(4-methylmorpholin-4-ium-4-yl)thiolane 1,1-dioxide Traditional Name: 3-(4-methylmorpholin-4-ium-4-yl)sulfolane besylate Formula: C15H23NO6S2 MolecularWeight: 377.47622

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)C2CCS(=O)(=O)C2.C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCOCC1)C2CCS(=O)(=O)C2.C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C9H18NO3S.C6H6O3S/c1-10(3-5-13-6-4-10)9-2-7-14(11,12)8-9;7-10(8,9)6-4-2-1-3-5-6/h9H,2-8H2,1H3;1-5H,(H,7,8,9)/q+1;/p-1