methyl 2-tert-butylsulfonyl-5-(hydroxymethyl)benzoate

Systemtic Name: methyl 2-tert-butylsulfonyl-5-(hydroxymethyl)benzoate Openeye Name: methyl 2-tert-butylsulfonyl-5-(hydroxymethyl)benzoate CAS Name: 2-tert-butylsulfonyl-5-(hydroxymethyl)benzoic acid methyl ester IUPAC Name: methyl 2-tert-butylsulfonyl-5-(hydroxymethyl)benzoate Traditional Name: 2-tert-butylsulfonyl-5-methylol-benzoic acid methyl ester Formula: C13H18O5S MolecularWeight: 286.34402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O5S/c1-13(2,3)19(16,17)11-6-5-9(8-14)7-10(11)12(15)18-4/h5-7,14H,8H2,1-4H3