4-[[2-(7-chloranylquinolin-2-yl)-1-benzofuran-5-yl]amino]-2,2-dimethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-(7-chloranylquinolin-2-yl)-1-benzofuran-5-yl]amino]-2,2-dimethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-(7-chloro-2-quinolyl)benzofuran-5-yl]amino]-2,2-dimethyl-4-oxo-butanoic acid CAS Name: 4-[[2-(7-chloro-2-quinolinyl)-5-benzofuranyl]amino]-2,2-dimethyl-4-oxobutanoic acid IUPAC Name: 4-[[2-(7-chloroquinolin-2-yl)-1-benzofuran-5-yl]amino]-2,2-dimethyl-4-oxobutanoic acid Traditional Name: 4-[[2-(7-chloro-2-quinolyl)benzofuran-5-yl]amino]-4-keto-2,2-dimethyl-butyric acid Formula: C23H19ClN2O4 MolecularWeight: 422.86096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC2=C(C=C1)OC(=C2)C3=NC4=C(C=CC(=C4)Cl)C=C3)C(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=CC2=C(C=C1)OC(=C2)C3=NC4=C(C=CC(=C4)Cl)C=C3)C(=O)O

InChI

InChI=1S/C23H19ClN2O4/c1-23(2,22(28)29)12-21(27)25-16-6-8-19-14(9-16)10-20(30-19)17-7-4-13-3-5-15(24)11-18(13)26-17/h3-11H,12H2,1-2H3,(H,25,27)(H,28,29)