(3,4-dimethylphenyl) 4-methylsulfonylbenzoate

Systemtic Name: (3,4-dimethylphenyl) 4-methylsulfonylbenzoate Openeye Name: (3,4-dimethylphenyl) 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid (3,4-dimethylphenyl) ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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