methyl 3-[2-(7-chloranylquinolin-2-yl)-1-benzofuran-5-yl]-2,2-dimethyl-3-oxidanyl-propanoate

Systemtic Name: methyl 3-[2-(7-chloranylquinolin-2-yl)-1-benzofuran-5-yl]-2,2-dimethyl-3-oxidanyl-propanoate Openeye Name: methyl 3-[2-(7-chloro-2-quinolyl)benzofuran-5-yl]-3-hydroxy-2,2-dimethyl-propanoate CAS Name: 3-[2-(7-chloro-2-quinolinyl)-5-benzofuranyl]-3-hydroxy-2,2-dimethylpropanoic acid methyl ester IUPAC Name: methyl 3-[2-(7-chloroquinolin-2-yl)-1-benzofuran-5-yl]-3-hydroxy-2,2-dimethylpropanoate Traditional Name: 3-[2-(7-chloro-2-quinolyl)benzofuran-5-yl]-3-hydroxy-2,2-dimethyl-propionic acid methyl ester Formula: C23H20ClNO4 MolecularWeight: 409.8622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC2=C(C=C1)OC(=C2)C3=NC4=C(C=CC(=C4)Cl)C=C3)O)C(=O)OC

Isomeric SMILES

CC(C)(C(C1=CC2=C(C=C1)OC(=C2)C3=NC4=C(C=CC(=C4)Cl)C=C3)O)C(=O)OC

InChI

InChI=1S/C23H20ClNO4/c1-23(2,22(27)28-3)21(26)14-6-9-19-15(10-14)11-20(29-19)17-8-5-13-4-7-16(24)12-18(13)25-17/h4-12,21,26H,1-3H3