(2,5-dimethylphenyl) 4-chloranyl-3-methoxy-benzenesulfonate

Systemtic Name: (2,5-dimethylphenyl) 4-chloranyl-3-methoxy-benzenesulfonate Openeye Name: (2,5-dimethylphenyl) 4-chloro-3-methoxy-benzenesulfonate CAS Name: 4-chloro-3-methoxybenzenesulfonic acid (2,5-dimethylphenyl) ester IUPAC Name: (2,5-dimethylphenyl) 4-chloro-3-methoxybenzenesulfonate Traditional Name: 4-chloro-3-methoxy-benzenesulfonic acid (2,5-dimethylphenyl) ester Formula: C15H15ClO4S MolecularWeight: 326.7952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OS(=O)(=O)C2=CC(=C(C=C2)Cl)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)OS(=O)(=O)C2=CC(=C(C=C2)Cl)OC

InChI

InChI=1S/C15H15ClO4S/c1-10-4-5-11(2)14(8-10)20-21(17,18)12-6-7-13(16)15(9-12)19-3/h4-9H,1-3H3