4-cyclohexyl-2-methyl-5-methylsulfonyl-benzoic acid

Systemtic Name: 4-cyclohexyl-2-methyl-5-methylsulfonyl-benzoic acid Openeye Name: 4-cyclohexyl-2-methyl-5-methylsulfonyl-benzoic acid CAS Name: 4-cyclohexyl-2-methyl-5-methylsulfonylbenzoic acid IUPAC Name: 4-cyclohexyl-2-methyl-5-methylsulfonylbenzoic acid Traditional Name: 4-cyclohexyl-5-mesyl-2-methyl-benzoic acid Formula: C15H20O4S MolecularWeight: 296.3819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)C2CCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)C2CCCCC2

InChI

InChI=1S/C15H20O4S/c1-10-8-13(11-6-4-3-5-7-11)14(20(2,18)19)9-12(10)15(16)17/h8-9,11H,3-7H2,1-2H3,(H,16,17)