2-ethyl-4-methoxy-5-methylsulfonyl-benzoic acid

Systemtic Name: 2-ethyl-4-methoxy-5-methylsulfonyl-benzoic acid Openeye Name: 2-ethyl-4-methoxy-5-methylsulfonyl-benzoic acid CAS Name: 2-ethyl-4-methoxy-5-methylsulfonylbenzoic acid IUPAC Name: 2-ethyl-4-methoxy-5-methylsulfonylbenzoic acid Traditional Name: 2-ethyl-5-mesyl-4-methoxy-benzoic acid Formula: C11H14O5S MolecularWeight: 258.29086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)OC

InChI

InChI=1S/C11H14O5S/c1-4-7-5-9(16-2)10(17(3,14)15)6-8(7)11(12)13/h5-6H,4H2,1-3H3,(H,12,13)