(4-tert-butylphenyl)methyl 3-methylsulfonylbenzoate

Systemtic Name: (4-tert-butylphenyl)methyl 3-methylsulfonylbenzoate Openeye Name: (4-tert-butylphenyl)methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (4-tert-butylbenzyl) ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H22O4S/c1-19(2,3)16-10-8-14(9-11-16)13-23-18(20)15-6-5-7-17(12-15)24(4,21)22/h5-12H,13H2,1-4H3