3-[[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]sulfamoyl]-4-methoxy-benzoate

Systemtic Name: 3-[[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]sulfamoyl]-4-methoxy-benzoate Openeye Name: 3-[[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]sulfamoyl]-4-methoxy-benzoate CAS Name: 3-[[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]sulfamoyl]-4-methoxybenzoate IUPAC Name: 3-[[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]sulfamoyl]-4-methoxybenzoate Traditional Name: 3-[[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]sulfamoyl]-4-methoxy-benzoate Formula: C22H20BrN2O8S2- MolecularWeight: 584.4368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])OC

InChI

InChI=1S/C22H21BrN2O8S2/c1-3-33-19-11-5-15(23)13-21(19)35(30,31)25-17-8-6-16(7-9-17)24-34(28,29)20-12-14(22(26)27)4-10-18(20)32-2/h4-13,24-25H,3H2,1-2H3,(H,26,27)/p-1