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

Systemtic Name: (2,6-dimethylphenyl) 4-bromanyl-3-(dimethylsulfamoyl)benzoate Openeye Name: (2,6-dimethylphenyl) 4-bromo-3-(dimethylsulfamoyl)benzoate CAS Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-bromo-3-(dimethylsulfamoyl)benzoate Traditional Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (2,6-dimethylphenyl) ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrNO4S/c1-11-6-5-7-12(2)16(11)23-17(20)13-8-9-14(18)15(10-13)24(21,22)19(3)4/h5-10H,1-4H3