3-[(2-methyl-3-propoxycarbonyl-benzo[g][1]benzofuran-5-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(2-methyl-3-propoxycarbonyl-benzo[g][1]benzofuran-5-yl)sulfamoyl]benzoic acid Openeye Name: 3-[(2-methyl-3-propoxycarbonyl-benzo[g]benzofuran-5-yl)sulfamoyl]benzoic acid CAS Name: 3-[[2-methyl-3-[oxo(propoxy)methyl]-5-benzo[g]benzofuranyl]sulfamoyl]benzoic acid IUPAC Name: 3-[(2-methyl-3-propoxycarbonylbenzo[g][1]benzofuran-5-yl)sulfamoyl]benzoic acid Traditional Name: 3-[(2-methyl-3-propoxycarbonyl-benzo[g]benzofuran-5-yl)sulfamoyl]benzoic acid Formula: C24H21NO7S MolecularWeight: 467.49104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC=CC(=C4)C(=O)O)C

Isomeric SMILES

CCCOC(=O)C1=C(OC2=C1C=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC=CC(=C4)C(=O)O)C

InChI

InChI=1S/C24H21NO7S/c1-3-11-31-24(28)21-14(2)32-22-18-10-5-4-9-17(18)20(13-19(21)22)25-33(29,30)16-8-6-7-15(12-16)23(26)27/h4-10,12-13,25H,3,11H2,1-2H3,(H,26,27)