methyl 2-methoxy-5-methylsulfonyl-3-(1-oxidanylpropan-2-yl)benzoate

Systemtic Name: methyl 2-methoxy-5-methylsulfonyl-3-(1-oxidanylpropan-2-yl)benzoate Openeye Name: methyl 3-(2-hydroxy-1-methyl-ethyl)-2-methoxy-5-methylsulfonyl-benzoate CAS Name: 3-(1-hydroxypropan-2-yl)-2-methoxy-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-(1-hydroxypropan-2-yl)-2-methoxy-5-methylsulfonylbenzoate Traditional Name: 3-(2-hydroxy-1-methyl-ethyl)-5-mesyl-2-methoxy-benzoic acid methyl ester Formula: C13H18O6S MolecularWeight: 302.34342

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C1=C(C(=CC(=C1)S(=O)(=O)C)C(=O)OC)OC

Isomeric SMILES

CC(CO)C1=C(C(=CC(=C1)S(=O)(=O)C)C(=O)OC)OC

InChI

InChI=1S/C13H18O6S/c1-8(7-14)10-5-9(20(4,16)17)6-11(12(10)18-2)13(15)19-3/h5-6,8,14H,7H2,1-4H3