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

Systemtic Name: 2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]-methoxycarbonyl-amino]-5-propan-2-yloxy-benzoic acid Openeye Name: 2-[[5-(4-fluorophenyl)benzofuran-2-yl]-methoxycarbonyl-amino]-5-isopropoxy-benzoic acid CAS Name: 2-[[5-(4-fluorophenyl)-2-benzofuranyl]-methoxycarbonylamino]-5-propan-2-yloxybenzoic acid IUPAC Name: 2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]-methoxycarbonylamino]-5-propan-2-yloxybenzoic acid Traditional Name: 2-[carbomethoxy-[5-(4-fluorophenyl)benzofuran-2-yl]amino]-5-isopropoxy-benzoic acid Formula: C26H22FNO6 MolecularWeight: 463.454383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)N(C2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC)C(=O)O

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)N(C2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC)C(=O)O

InChI

InChI=1S/C26H22FNO6/c1-15(2)33-20-9-10-22(21(14-20)25(29)30)28(26(31)32-3)24-13-18-12-17(6-11-23(18)34-24)16-4-7-19(27)8-5-16/h4-15H,1-3H3,(H,29,30)