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

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 3-(dimethylsulfamoyl)benzoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 3-(dimethylsulfamoyl)benzoate CAS Name: 3-(dimethylsulfamoyl)benzoic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 3-(dimethylsulfamoyl)benzoate Traditional Name: 3-(dimethylsulfamoyl)benzoic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C18H17BrN2O5S MolecularWeight: 453.30698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN2O5S/c1-4-25-16-9-12(11-20)8-15(19)17(16)26-18(22)13-6-5-7-14(10-13)27(23,24)21(2)3/h5-10H,4H2,1-3H3