4-methylbenzenesulfonate; pyrrolidin-2-one

Systemtic Name: 4-methylbenzenesulfonate; pyrrolidin-2-one Openeye Name: 4-methylbenzenesulfonate; pyrrolidin-2-one CAS Name: 4-methylbenzenesulfonate; 2-pyrrolidinone IUPAC Name: 4-methylbenzenesulfonate; pyrrolidin-2-one Traditional Name: 2-pyrrolidone tosylate Formula: C11H14NO4S- MolecularWeight: 256.29816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(=O)NC1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(=O)NC1

InChI

InChI=1S/C7H8O3S.C4H7NO/c1-6-2-4-7(5-3-6)11(8,9)10;6-4-2-1-3-5-4/h2-5H,1H3,(H,8,9,10);1-3H2,(H,5,6)/p-1