3-[4-[acridin-9-yloxycarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[acridin-9-yloxycarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[acridin-9-yloxycarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[9-acridinyloxy(oxo)methyl]-(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[acridin-9-yloxycarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[acridin-9-yloxycarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propionic acid Formula: C31H24N2O8S MolecularWeight: 584.59586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N(C(=O)OC3=C4C=CC=CC4=NC5=CC=CC=C53)S(=O)(=O)C6=CC=C(C=C6)CCC(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N(C(=O)OC3=C4C=CC=CC4=NC5=CC=CC=C53)S(=O)(=O)C6=CC=C(C=C6)CCC(=O)O

InChI

InChI=1S/C31H24N2O8S/c34-29(35)16-11-20-9-13-22(14-10-20)42(37,38)33(21-12-15-27-28(19-21)40-18-17-39-27)31(36)41-30-23-5-1-3-7-25(23)32-26-8-4-2-6-24(26)30/h1-10,12-15,19H,11,16-18H2,(H,34,35)