(2-acetamido-2-oxidanylidene-ethyl) 4-methylbenzenesulfonate

Systemtic Name: (2-acetamido-2-oxidanylidene-ethyl) 4-methylbenzenesulfonate Openeye Name: (2-acetamido-2-oxo-ethyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-acetamido-2-oxoethyl) ester IUPAC Name: (2-acetamido-2-oxoethyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-acetamido-2-keto-ethyl) ester Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)NC(=O)C

InChI

InChI=1S/C11H13NO5S/c1-8-3-5-10(6-4-8)18(15,16)17-7-11(14)12-9(2)13/h3-6H,7H2,1-2H3,(H,12,13,14)