[(1R)-1-cyanoethyl] 2-bromanyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-bromanyl-5-(dimethylsulfamoyl)benzoate Openeye Name: [(1R)-1-cyanoethyl] 2-bromo-5-(dimethylsulfamoyl)benzoate CAS Name: 2-bromo-5-(dimethylsulfamoyl)benzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-bromo-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-bromo-5-(dimethylsulfamoyl)benzoic acid [(1R)-1-cyanoethyl] ester Formula: C12H13BrN2O4S MolecularWeight: 361.21162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)Br

InChI

InChI=1S/C12H13BrN2O4S/c1-8(7-14)19-12(16)10-6-9(4-5-11(10)13)20(17,18)15(2)3/h4-6,8H,1-3H3/t8-/m1/s1