dimethyl 2-[(3-bromanyl-2-ethoxy-5-fluoranyl-phenyl)sulfamoyl]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(3-bromanyl-2-ethoxy-5-fluoranyl-phenyl)sulfamoyl]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(3-bromo-2-ethoxy-5-fluoro-phenyl)sulfamoyl]benzene-1,4-dicarboxylate CAS Name: 2-[(3-bromo-2-ethoxy-5-fluorophenyl)sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(3-bromo-2-ethoxy-5-fluorophenyl)sulfamoyl]benzene-1,4-dicarboxylate Traditional Name: 2-[(3-bromo-2-ethoxy-5-fluoro-phenyl)sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C18H17BrFNO7S MolecularWeight: 490.297483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC)F)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC)F)Br

InChI

InChI=1S/C18H17BrFNO7S/c1-4-28-16-13(19)8-11(20)9-14(16)21-29(24,25)15-7-10(17(22)26-2)5-6-12(15)18(23)27-3/h5-9,21H,4H2,1-3H3