3-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[2-(2-bromo-4,5-dimethoxyphenyl)ethylsulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[2-(2-bromo-4,5-dimethoxyphenyl)ethylsulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4,5-dimethyl-benzoic acid Formula: C19H22BrNO6S MolecularWeight: 472.35008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCCC2=CC(=C(C=C2Br)OC)OC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCCC2=CC(=C(C=C2Br)OC)OC)C

InChI

InChI=1S/C19H22BrNO6S/c1-11-7-14(19(22)23)9-18(12(11)2)28(24,25)21-6-5-13-8-16(26-3)17(27-4)10-15(13)20/h7-10,21H,5-6H2,1-4H3,(H,22,23)