(2-bromanyl-4-cyano-6-ethoxy-phenyl) 4,5-dimethoxy-2-methyl-benzenesulfonate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 4,5-dimethoxy-2-methyl-benzenesulfonate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 4,5-dimethoxy-2-methyl-benzenesulfonate CAS Name: 4,5-dimethoxy-2-methylbenzenesulfonic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 4,5-dimethoxy-2-methylbenzenesulfonate Traditional Name: 4,5-dimethoxy-2-methyl-benzenesulfonic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C18H18BrNO6S MolecularWeight: 456.30762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC(=C(C=C2C)OC)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC(=C(C=C2C)OC)OC

InChI

InChI=1S/C18H18BrNO6S/c1-5-25-16-8-12(10-20)7-13(19)18(16)26-27(21,22)17-9-15(24-4)14(23-3)6-11(17)2/h6-9H,5H2,1-4H3