(6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-(methylsulfamoyl)benzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-(methylsulfamoyl)benzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-(methylsulfamoyl)benzoate CAS Name: 3-(methylsulfamoyl)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-(methylsulfamoyl)benzoate Traditional Name: 3-(methylsulfamoyl)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C16H14BrNO6S MolecularWeight: 428.25446

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H14BrNO6S/c1-18-25(20,21)12-4-2-3-10(5-12)16(19)22-8-11-6-14-15(7-13(11)17)24-9-23-14/h2-7,18H,8-9H2,1H3