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

Systemtic Name: (2-methylphenyl)methyl 4-bromanyl-3-(dimethylsulfamoyl)benzoate Openeye Name: o-tolylmethyl 4-bromo-3-(dimethylsulfamoyl)benzoate CAS Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 4-bromo-3-(dimethylsulfamoyl)benzoate Traditional Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid (2-methylbenzyl) ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N(C)C

InChI

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