(4-acetamido-4,5-dihydro-1,2-oxazol-3-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-acetamido-4,5-dihydro-1,2-oxazol-3-yl) 4-methylbenzenesulfonate Openeye Name: (4-acetamido-4,5-dihydroisoxazol-3-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-acetamido-4,5-dihydroisoxazol-3-yl) ester IUPAC Name: (4-acetamido-4,5-dihydro-1,2-oxazol-3-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-acetamido-2-isoxazolin-3-yl) ester Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=NOCC2NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=NOCC2NC(=O)C

InChI

InChI=1S/C12H14N2O5S/c1-8-3-5-10(6-4-8)20(16,17)19-12-11(7-18-14-12)13-9(2)15/h3-6,11H,7H2,1-2H3,(H,13,15)