(2-methoxy-4-methyl-phenyl) 4-bromanyl-2-chloranyl-benzenesulfonate

Systemtic Name: (2-methoxy-4-methyl-phenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: (2-methoxy-4-methyl-phenyl) 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (2-methoxy-4-methylphenyl) ester IUPAC Name: (2-methoxy-4-methylphenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid (2-methoxy-4-methyl-phenyl) ester Formula: C14H12BrClO4S MolecularWeight: 391.66468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrClO4S/c1-9-3-5-12(13(7-9)19-2)20-21(17,18)14-6-4-10(15)8-11(14)16/h3-8H,1-2H3