4,4-dimethyl-1,3-oxazolidin-3-ium; 2-methylbenzenesulfonate

Systemtic Name: 4,4-dimethyl-1,3-oxazolidin-3-ium; 2-methylbenzenesulfonate Openeye Name: 4,4-dimethyloxazolidin-3-ium; 2-methylbenzenesulfonate CAS Name: 4,4-dimethyloxazolidin-3-ium; 2-methylbenzenesulfonate IUPAC Name: 4,4-dimethyl-1,3-oxazolidin-3-ium; 2-methylbenzenesulfonate Traditional Name: 4,4-dimethyloxazolidin-3-ium; 2-methylbesylate Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)[O-].CC1(COC[NH2+]1)C

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)[O-].CC1(COC[NH2+]1)C

InChI

InChI=1S/C7H8O3S.C5H11NO/c1-6-4-2-3-5-7(6)11(8,9)10;1-5(2)3-7-4-6-5/h2-5H,1H3,(H,8,9,10);6H,3-4H2,1-2H3