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

Systemtic Name: (4-cyano-2-methoxy-phenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: (4-cyano-2-methoxy-phenyl) 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid (4-cyano-2-methoxy-phenyl) ester Formula: C14H9BrClNO4S MolecularWeight: 402.64756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C14H9BrClNO4S/c1-20-13-6-9(8-17)2-4-12(13)21-22(18,19)14-5-3-10(15)7-11(14)16/h2-7H,1H3