2-(1-benzofuran-2-ylmethoxycarbonylamino)-5-(4-fluorophenyl)-3-phenyl-benzoic acid

Systemtic Name: 2-(1-benzofuran-2-ylmethoxycarbonylamino)-5-(4-fluorophenyl)-3-phenyl-benzoic acid Openeye Name: 2-(benzofuran-2-ylmethoxycarbonylamino)-5-(4-fluorophenyl)-3-phenyl-benzoic acid CAS Name: 2-[[2-benzofuranylmethoxy(oxo)methyl]amino]-5-(4-fluorophenyl)-3-phenylbenzoic acid IUPAC Name: 2-(1-benzofuran-2-ylmethoxycarbonylamino)-5-(4-fluorophenyl)-3-phenylbenzoic acid Traditional Name: 2-(benzofuran-2-ylmethoxycarbonylamino)-5-(4-fluorophenyl)-3-phenyl-benzoic acid Formula: C29H20FNO5 MolecularWeight: 481.471203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=CC(=C2)C3=CC=C(C=C3)F)C(=O)O)NC(=O)OCC4=CC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=CC(=C2)C3=CC=C(C=C3)F)C(=O)O)NC(=O)OCC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C29H20FNO5/c30-22-12-10-18(11-13-22)21-15-24(19-6-2-1-3-7-19)27(25(16-21)28(32)33)31-29(34)35-17-23-14-20-8-4-5-9-26(20)36-23/h1-16H,17H2,(H,31,34)(H,32,33)