3-[[2-(7-chloranylquinolin-2-yl)-1-benzofuran-6-yl]oxy]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[[2-(7-chloranylquinolin-2-yl)-1-benzofuran-6-yl]oxy]-2,2-dimethyl-propanoic acid Openeye Name: 3-[2-(7-chloro-2-quinolyl)benzofuran-6-yl]oxy-2,2-dimethyl-propanoic acid CAS Name: 3-[[2-(7-chloro-2-quinolinyl)-6-benzofuranyl]oxy]-2,2-dimethylpropanoic acid IUPAC Name: 3-[[2-(7-chloroquinolin-2-yl)-1-benzofuran-6-yl]oxy]-2,2-dimethylpropanoic acid Traditional Name: 3-[2-(7-chloro-2-quinolyl)benzofuran-6-yl]oxy-2,2-dimethyl-propionic acid Formula: C22H18ClNO4 MolecularWeight: 395.83562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC2=C(C=C1)C=C(O2)C3=NC4=C(C=CC(=C4)Cl)C=C3)C(=O)O

Isomeric SMILES

CC(C)(COC1=CC2=C(C=C1)C=C(O2)C3=NC4=C(C=CC(=C4)Cl)C=C3)C(=O)O

InChI

InChI=1S/C22H18ClNO4/c1-22(2,21(25)26)12-27-16-7-4-14-9-20(28-19(14)11-16)17-8-5-13-3-6-15(23)10-18(13)24-17/h3-11H,12H2,1-2H3,(H,25,26)