5-(2,3-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonyl-benzoate

Systemtic Name: 5-(2,3-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonyl-benzoate Openeye Name: 5-(2,3-dihydroisoxazol-3-yl)-2-methyl-4-methylsulfonyl-benzoate CAS Name: 5-(2,3-dihydroisoxazol-3-yl)-2-methyl-4-methylsulfonylbenzoate IUPAC Name: 5-(2,3-dihydro-1,2-oxazol-3-yl)-2-methyl-4-methylsulfonylbenzoate Traditional Name: 5-(4-isoxazolin-3-yl)-4-mesyl-2-methyl-benzoate Formula: C12H12NO5S- MolecularWeight: 282.29238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)[O-])C2C=CON2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)[O-])C2C=CON2)S(=O)(=O)C

InChI

InChI=1S/C12H13NO5S/c1-7-5-11(19(2,16)17)9(6-8(7)12(14)15)10-3-4-18-13-10/h3-6,10,13H,1-2H3,(H,14,15)/p-1