3-bromanyl-4-[2-cyanoethyl(methyl)sulfamoyl]benzoate

Systemtic Name: 3-bromanyl-4-[2-cyanoethyl(methyl)sulfamoyl]benzoate Openeye Name: 3-bromo-4-[2-cyanoethyl(methyl)sulfamoyl]benzoate CAS Name: 3-bromo-4-[2-cyanoethyl(methyl)sulfamoyl]benzoate IUPAC Name: 3-bromo-4-[2-cyanoethyl(methyl)sulfamoyl]benzoate Traditional Name: 3-bromo-4-[2-cyanoethyl(methyl)sulfamoyl]benzoate Formula: C11H10BrN2O4S- MolecularWeight: 346.1771

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)S(=O)(=O)C1=C(C=C(C=C1)C(=O)[O-])Br

Isomeric SMILES

CN(CCC#N)S(=O)(=O)C1=C(C=C(C=C1)C(=O)[O-])Br

InChI

InChI=1S/C11H11BrN2O4S/c1-14(6-2-5-13)19(17,18)10-4-3-8(11(15)16)7-9(10)12/h3-4,7H,2,6H2,1H3,(H,15,16)/p-1