2-cyano-6-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid

Systemtic Name: 2-cyano-6-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid Openeye Name: 2-cyano-6-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]benzoic acid CAS Name: 2-cyano-6-[[[5-(4-fluorophenyl)-2-benzofuranyl]methoxy-oxomethyl]amino]benzoic acid IUPAC Name: 2-cyano-6-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid Traditional Name: 2-cyano-6-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]benzoic acid Formula: C24H15FN2O5 MolecularWeight: 430.384703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F)C(=O)O)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F)C(=O)O)C#N

InChI

InChI=1S/C24H15FN2O5/c25-18-7-4-14(5-8-18)15-6-9-21-17(10-15)11-19(32-21)13-31-24(30)27-20-3-1-2-16(12-26)22(20)23(28)29/h1-11H,13H2,(H,27,30)(H,28,29)