3-[[2-(7-chloranylquinolin-2-yl)-1-benzofuran-5-yl]oxymethyl]benzoic acid

Systemtic Name: 3-[[2-(7-chloranylquinolin-2-yl)-1-benzofuran-5-yl]oxymethyl]benzoic acid Openeye Name: 3-[[2-(7-chloro-2-quinolyl)benzofuran-5-yl]oxymethyl]benzoic acid CAS Name: 3-[[2-(7-chloro-2-quinolinyl)-5-benzofuranyl]oxymethyl]benzoic acid IUPAC Name: 3-[[2-(7-chloroquinolin-2-yl)-1-benzofuran-5-yl]oxymethyl]benzoic acid Traditional Name: 3-[[2-(7-chloro-2-quinolyl)benzofuran-5-yl]oxymethyl]benzoic acid Formula: C25H16ClNO4 MolecularWeight: 429.85184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC2=CC3=C(C=C2)OC(=C3)C4=NC5=C(C=CC(=C5)Cl)C=C4)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)COC2=CC3=C(C=C2)OC(=C3)C4=NC5=C(C=CC(=C5)Cl)C=C4)C(=O)O

InChI

InChI=1S/C25H16ClNO4/c26-19-6-4-16-5-8-21(27-22(16)13-19)24-12-18-11-20(7-9-23(18)31-24)30-14-15-2-1-3-17(10-15)25(28)29/h1-13H,14H2,(H,28,29)