3-azanyl-1,4-bis(oxidanyl)pyrrolidin-2-one; 4-methylbenzenesulfonic acid

Systemtic Name: 3-azanyl-1,4-bis(oxidanyl)pyrrolidin-2-one; 4-methylbenzenesulfonic acid Openeye Name: 3-amino-1,4-dihydroxy-pyrrolidin-2-one; 4-methylbenzenesulfonic acid CAS Name: 3-amino-1,4-dihydroxy-2-pyrrolidinone; 4-methylbenzenesulfonic acid IUPAC Name: 3-amino-1,4-dihydroxypyrrolidin-2-one; 4-methylbenzenesulfonic acid Traditional Name: 3-amino-1,4-dihydroxy-2-pyrrolidone; tosylic acid Formula: C11H16N2O6S MolecularWeight: 304.31954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1C(C(C(=O)N1O)N)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1C(C(C(=O)N1O)N)O

InChI

InChI=1S/C7H8O3S.C4H8N2O3/c1-6-2-4-7(5-3-6)11(8,9)10;5-3-2(7)1-6(9)4(3)8/h2-5H,1H3,(H,8,9,10);2-3,7,9H,1,5H2