(4-tert-butyl-2-methyl-phenyl) 2-methylsulfonylbenzoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 2-methylsulfonylbenzoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C19H22O4S/c1-13-12-14(19(2,3)4)10-11-16(13)23-18(20)15-8-6-7-9-17(15)24(5,21)22/h6-12H,1-5H3