(4-methylphenyl)methyl 4-bromanyl-3-(dimethylsulfamoyl)benzoate

Systemtic Name: (4-methylphenyl)methyl 4-bromanyl-3-(dimethylsulfamoyl)benzoate Openeye Name: p-tolylmethyl 4-bromo-3-(dimethylsulfamoyl)benzoate CAS Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-bromo-3-(dimethylsulfamoyl)benzoate Traditional Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (4-methylbenzyl) ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrNO4S/c1-12-4-6-13(7-5-12)11-23-17(20)14-8-9-15(18)16(10-14)24(21,22)19(2)3/h4-10H,11H2,1-3H3