2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)pentanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-3H-2-benzofuran-5-yl)pentanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl]-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-N-(1-oxo-3H-isobenzofuran-5-yl)pentanamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl]-4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-N-(1-oxo-3H-isobenzofuran-5-yl)pentanamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl]-4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-N-(1-oxo-3H-2-benzofuran-5-yl)pentanamide Traditional Name: 2-(2-chloro-6-fluoro-benzyl)-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-N-(1-ketophthalan-5-yl)-4-methyl-valeramide Formula: C28H26ClF2NO5 MolecularWeight: 529.959546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=C(C=CC=C1Cl)F)(C(=O)NC2=CC3=C(C=C2)C(=O)OC3)O)C4=C(C=CC(=C4)F)OC

Isomeric SMILES

CC(C)(CC(CC1=C(C=CC=C1Cl)F)(C(=O)NC2=CC3=C(C=C2)C(=O)OC3)O)C4=C(C=CC(=C4)F)OC

InChI

InChI=1S/C28H26ClF2NO5/c1-27(2,21-12-17(30)7-10-24(21)36-3)15-28(35,13-20-22(29)5-4-6-23(20)31)26(34)32-18-8-9-19-16(11-18)14-37-25(19)33/h4-12,35H,13-15H2,1-3H3,(H,32,34)