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

Systemtic Name: 3-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[2-(2-bromo-4,5-dimethoxyphenyl)ethylsulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[2-(2-bromo-4,5-dimethoxyphenyl)ethylsulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[2-(2-bromo-4,5-dimethoxy-phenyl)ethylsulfamoyl]-4-methoxy-benzoic acid Formula: C18H20BrNO7S MolecularWeight: 474.3229

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C18H20BrNO7S/c1-25-14-5-4-12(18(21)22)9-17(14)28(23,24)20-7-6-11-8-15(26-2)16(27-3)10-13(11)19/h4-5,8-10,20H,6-7H2,1-3H3,(H,21,22)