2-[2-(2-chloranyl-5-fluoranyl-phenyl)-2-methyl-propyl]-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)pent-3-ynamide

Systemtic Name: 2-[2-(2-chloranyl-5-fluoranyl-phenyl)-2-methyl-propyl]-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)pent-3-ynamide Openeye Name: 2-[2-(2-chloro-5-fluoro-phenyl)-2-methyl-propyl]-2-hydroxy-N-(1-oxo-3H-isobenzofuran-5-yl)pent-3-ynamide CAS Name: 2-[2-(2-chloro-5-fluorophenyl)-2-methylpropyl]-2-hydroxy-N-(1-oxo-3H-isobenzofuran-5-yl)-3-pentynamide IUPAC Name: 2-[2-(2-chloro-5-fluorophenyl)-2-methylpropyl]-2-hydroxy-N-(1-oxo-3H-2-benzofuran-5-yl)pent-3-ynamide Traditional Name: 2-[2-(2-chloro-5-fluoro-phenyl)-2-methyl-propyl]-2-hydroxy-N-(1-ketophthalan-5-yl)pent-3-ynamide Formula: C23H21ClFNO4 MolecularWeight: 429.868543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClFNO4/c1-4-9-23(29,13-22(2,3)18-11-15(25)5-8-19(18)24)21(28)26-16-6-7-17-14(10-16)12-30-20(17)27/h5-8,10-11,29H,12-13H2,1-3H3,(H,26,28)