(4-cyclohexylphenyl) 3-methylsulfonylbenzoate

Systemtic Name: (4-cyclohexylphenyl) 3-methylsulfonylbenzoate Openeye Name: (4-cyclohexylphenyl) 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (4-cyclohexylphenyl) ester IUPAC Name: (4-cyclohexylphenyl) 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (4-cyclohexylphenyl) ester Formula: C20H22O4S MolecularWeight: 358.45128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C20H22O4S/c1-25(22,23)19-9-5-8-17(14-19)20(21)24-18-12-10-16(11-13-18)15-6-3-2-4-7-15/h5,8-15H,2-4,6-7H2,1H3