(2-bromanyl-4-cyano-6-ethoxy-phenyl) 3-(dimethylsulfamoyl)-4,5-dimethyl-benzoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 3-(dimethylsulfamoyl)-4,5-dimethyl-benzoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 3-(dimethylsulfamoyl)-4,5-dimethyl-benzoate CAS Name: 3-(dimethylsulfamoyl)-4,5-dimethylbenzoic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 3-(dimethylsulfamoyl)-4,5-dimethylbenzoate Traditional Name: 3-(dimethylsulfamoyl)-4,5-dimethyl-benzoic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O5S/c1-6-27-17-9-14(11-22)8-16(21)19(17)28-20(24)15-7-12(2)13(3)18(10-15)29(25,26)23(4)5/h7-10H,6H2,1-5H3