4-methylbenzenesulfonate; 1-oxidanylpyrrolidine-2,5-dione

Systemtic Name: 4-methylbenzenesulfonate; 1-oxidanylpyrrolidine-2,5-dione Openeye Name: 1-hydroxypyrrolidine-2,5-dione; 4-methylbenzenesulfonate CAS Name: 1-hydroxypyrrolidine-2,5-dione; 4-methylbenzenesulfonate IUPAC Name: 1-hydroxypyrrolidine-2,5-dione; 4-methylbenzenesulfonate Traditional Name: 1-hydroxypyrrolidine-2,5-quinone tosylate Formula: C11H12NO6S- MolecularWeight: 286.28108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(=O)N(C1=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(=O)N(C1=O)O

InChI

InChI=1S/C7H8O3S.C4H5NO3/c1-6-2-4-7(5-3-6)11(8,9)10;6-3-1-2-4(7)5(3)8/h2-5H,1H3,(H,8,9,10);8H,1-2H2/p-1