5-(hydroxymethyl)-1-methyl-pyrrolidin-2-one; 4-methylbenzenesulfonic acid

Systemtic Name: 5-(hydroxymethyl)-1-methyl-pyrrolidin-2-one; 4-methylbenzenesulfonic acid Openeye Name: 5-(hydroxymethyl)-1-methyl-pyrrolidin-2-one; 4-methylbenzenesulfonic acid CAS Name: 5-(hydroxymethyl)-1-methyl-2-pyrrolidinone; 4-methylbenzenesulfonic acid IUPAC Name: 5-(hydroxymethyl)-1-methylpyrrolidin-2-one; 4-methylbenzenesulfonic acid Traditional Name: 1-methyl-5-methylol-2-pyrrolidone; tosylic acid Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CN1C(CCC1=O)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CN1C(CCC1=O)CO

InChI

InChI=1S/C7H8O3S.C6H11NO2/c1-6-2-4-7(5-3-6)11(8,9)10;1-7-5(4-8)2-3-6(7)9/h2-5H,1H3,(H,8,9,10);5,8H,2-4H2,1H3