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

Systemtic Name: 2-bromanyl-6-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid Openeye Name: 2-bromo-6-[[5-(4-fluorophenyl)benzofuran-2-yl]methoxycarbonylamino]benzoic acid CAS Name: 2-bromo-6-[[[5-(4-fluorophenyl)-2-benzofuranyl]methoxy-oxomethyl]amino]benzoic acid IUPAC Name: 2-bromo-6-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]methoxycarbonylamino]benzoic acid Traditional Name: 2-bromo-6-[[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(=C(C(=C1)Br)C(=O)O)NC(=O)OCC2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

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