methyl 4-tert-butyl-2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 4-tert-butyl-2-methyl-5-methylsulfonyl-benzoate Openeye Name: methyl 4-tert-butyl-2-methyl-5-methylsulfonyl-benzoate CAS Name: 4-tert-butyl-2-methyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-tert-butyl-2-methyl-5-methylsulfonylbenzoate Traditional Name: 4-tert-butyl-5-mesyl-2-methyl-benzoic acid methyl ester Formula: C14H20O4S MolecularWeight: 284.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)C(C)(C)C

InChI

InChI=1S/C14H20O4S/c1-9-7-11(14(2,3)4)12(19(6,16)17)8-10(9)13(15)18-5/h7-8H,1-6H3