(2,6-dimethylphenyl) 4-methylsulfonylbenzoate

Systemtic Name: (2,6-dimethylphenyl) 4-methylsulfonylbenzoate Openeye Name: (2,6-dimethylphenyl) 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid (2,6-dimethylphenyl) ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4S/c1-11-5-4-6-12(2)15(11)20-16(17)13-7-9-14(10-8-13)21(3,18)19/h4-10H,1-3H3