5-(4-fluorophenyl)-2-[methoxycarbonyl-(5-phenyl-1-benzofuran-2-yl)amino]benzoic acid

Systemtic Name: 5-(4-fluorophenyl)-2-[methoxycarbonyl-(5-phenyl-1-benzofuran-2-yl)amino]benzoic acid Openeye Name: 5-(4-fluorophenyl)-2-[methoxycarbonyl-(5-phenylbenzofuran-2-yl)amino]benzoic acid CAS Name: 5-(4-fluorophenyl)-2-[methoxycarbonyl-(5-phenyl-2-benzofuranyl)amino]benzoic acid IUPAC Name: 5-(4-fluorophenyl)-2-[methoxycarbonyl-(5-phenyl-1-benzofuran-2-yl)amino]benzoic acid Traditional Name: 2-[carbomethoxy-(5-phenylbenzofuran-2-yl)amino]-5-(4-fluorophenyl)benzoic acid Formula: C29H20FNO5 MolecularWeight: 481.471203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N(C1=C(C=C(C=C1)C2=CC=C(C=C2)F)C(=O)O)C3=CC4=C(O3)C=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)N(C1=C(C=C(C=C1)C2=CC=C(C=C2)F)C(=O)O)C3=CC4=C(O3)C=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H20FNO5/c1-35-29(34)31(25-13-9-21(16-24(25)28(32)33)19-7-11-23(30)12-8-19)27-17-22-15-20(10-14-26(22)36-27)18-5-3-2-4-6-18/h2-17H,1H3,(H,32,33)