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3-bromanyl-4-[ethyl(2-methylprop-2-enyl)sulfamoyl]benzoic acid

3-bromanyl-4-[ethyl(2-methylprop-2-enyl)sulfamoyl]benzoic acid

Systemtic Name:3-bromanyl-4-[ethyl(2-methylprop-2-enyl)sulfamoyl]benzoic acid
Openeye Name:3-bromo-4-[ethyl(2-methylallyl)sulfamoyl]benzoic acid
CAS Name:3-bromo-4-[ethyl(2-methylprop-2-enyl)sulfamoyl]benzoic acid
IUPAC Name:3-bromo-4-[ethyl(2-methylprop-2-enyl)sulfamoyl]benzoic acid
Traditional Name:3-bromo-4-[ethyl(2-methylallyl)sulfamoyl]benzoic acid
Formula: C13H16BrNO4S
MolecularWeight: 362.23944
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)S(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br


Isomeric SMILES

CCN(CC(=C)C)S(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br


InChI

InChI=1S/C13H16BrNO4S/c1-4-15(8-9(2)3)20(18,19)12-6-5-10(13(16)17)7-11(12)14/h5-7H,2,4,8H2,1,3H3,(H,16,17)


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