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

Systemtic Name: 5-bromanyl-2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid Openeye Name: 5-bromo-2-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]benzoic acid CAS Name: 5-bromo-2-[[[5-(4-fluorophenyl)-2-benzofuranyl]methoxy-oxomethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid Traditional Name: 5-bromo-2-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]benzoic acid Formula: C23H15BrFNO5 MolecularWeight: 484.271303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(C=C2)OC(=C3)COC(=O)NC4=C(C=C(C=C4)Br)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(C=C2)OC(=C3)COC(=O)NC4=C(C=C(C=C4)Br)C(=O)O)F

InChI

InChI=1S/C23H15BrFNO5/c24-16-4-7-20(19(11-16)22(27)28)26-23(29)30-12-18-10-15-9-14(3-8-21(15)31-18)13-1-5-17(25)6-2-13/h1-11H,12H2,(H,26,29)(H,27,28)