(2,3,6-trimethylphenyl) 4-bromanyl-3-(dimethylsulfamoyl)benzoate

Systemtic Name: (2,3,6-trimethylphenyl) 4-bromanyl-3-(dimethylsulfamoyl)benzoate Openeye Name: (2,3,6-trimethylphenyl) 4-bromo-3-(dimethylsulfamoyl)benzoate CAS Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 4-bromo-3-(dimethylsulfamoyl)benzoate Traditional Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (2,3,6-trimethylphenyl) ester Formula: C18H20BrNO4S MolecularWeight: 426.3247

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C18H20BrNO4S/c1-11-6-7-12(2)17(13(11)3)24-18(21)14-8-9-15(19)16(10-14)25(22,23)20(4)5/h6-10H,1-5H3