4-(2-chloranyl-5-fluoranyl-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-(2-phenylethynyl)pentanamide

Systemtic Name: 4-(2-chloranyl-5-fluoranyl-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)-2-(2-phenylethynyl)pentanamide Openeye Name: 4-(2-chloro-5-fluoro-phenyl)-2-hydroxy-4-methyl-N-(1-oxo-3H-isobenzofuran-5-yl)-2-(2-phenylethynyl)pentanamide CAS Name: 4-(2-chloro-5-fluorophenyl)-2-hydroxy-4-methyl-N-(1-oxo-3H-isobenzofuran-5-yl)-2-(2-phenylethynyl)pentanamide IUPAC Name: 4-(2-chloro-5-fluorophenyl)-2-hydroxy-4-methyl-N-(1-oxo-3H-2-benzofuran-5-yl)-2-(2-phenylethynyl)pentanamide Traditional Name: 2-[2-(2-chloro-5-fluoro-phenyl)-2-methyl-propyl]-2-hydroxy-N-(1-ketophthalan-5-yl)-4-phenyl-but-3-ynamide Formula: C28H23ClFNO4 MolecularWeight: 491.937923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C#CC1=CC=CC=C1)(C(=O)NC2=CC3=C(C=C2)C(=O)OC3)O)C4=C(C=CC(=C4)F)Cl

Isomeric SMILES

CC(C)(CC(C#CC1=CC=CC=C1)(C(=O)NC2=CC3=C(C=C2)C(=O)OC3)O)C4=C(C=CC(=C4)F)Cl

InChI

InChI=1S/C28H23ClFNO4/c1-27(2,23-15-20(30)8-11-24(23)29)17-28(34,13-12-18-6-4-3-5-7-18)26(33)31-21-9-10-22-19(14-21)16-35-25(22)32/h3-11,14-15,34H,16-17H2,1-2H3,(H,31,33)