4-bromanyl-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid

Systemtic Name: 4-bromanyl-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid Openeye Name: 4-bromo-3-(5-sulfamoylindolin-1-yl)sulfonyl-benzoic acid CAS Name: 4-bromo-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid IUPAC Name: 4-bromo-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid Traditional Name: 4-bromo-3-(5-sulfamoylindolin-1-yl)sulfonyl-benzoic acid Formula: C15H13BrN2O6S2 MolecularWeight: 461.30752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Br

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Br

InChI

InChI=1S/C15H13BrN2O6S2/c16-12-3-1-10(15(19)20)8-14(12)26(23,24)18-6-5-9-7-11(25(17,21)22)2-4-13(9)18/h1-4,7-8H,5-6H2,(H,19,20)(H2,17,21,22)