(1-methoxy-1-oxidanylidene-propan-2-yl) 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (1-methoxy-1-oxidanylidene-propan-2-yl) 2-methyl-5-methylsulfonyl-benzoate Openeye Name: (2-methoxy-1-methyl-2-oxo-ethyl) 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid (1-methoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-methoxy-1-oxopropan-2-yl) 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid (2-keto-2-methoxy-1-methyl-ethyl) ester Formula: C13H16O6S MolecularWeight: 300.32754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC(C)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC(C)C(=O)OC

InChI

InChI=1S/C13H16O6S/c1-8-5-6-10(20(4,16)17)7-11(8)13(15)19-9(2)12(14)18-3/h5-7,9H,1-4H3