(2-bromanyl-4,5-diethoxy-phenyl)methyl 4-methyl-3-sulfamoyl-benzoate

Systemtic Name: (2-bromanyl-4,5-diethoxy-phenyl)methyl 4-methyl-3-sulfamoyl-benzoate Openeye Name: (2-bromo-4,5-diethoxy-phenyl)methyl 4-methyl-3-sulfamoyl-benzoate CAS Name: 4-methyl-3-sulfamoylbenzoic acid (2-bromo-4,5-diethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-diethoxyphenyl)methyl 4-methyl-3-sulfamoylbenzoate Traditional Name: 4-methyl-3-sulfamoyl-benzoic acid (2-bromo-4,5-diethoxy-benzyl) ester Formula: C19H22BrNO6S MolecularWeight: 472.35008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)COC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)COC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N)Br)OCC

InChI

InChI=1S/C19H22BrNO6S/c1-4-25-16-8-14(15(20)10-17(16)26-5-2)11-27-19(22)13-7-6-12(3)18(9-13)28(21,23)24/h6-10H,4-5,11H2,1-3H3,(H2,21,23,24)