2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-pentanoic acid

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-pentanoic acid Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl]-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-pentanoic acid CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl]-4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methylpentanoic acid IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl]-4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methylpentanoic acid Traditional Name: 2-(2-chloro-6-fluoro-benzyl)-4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-valeric acid Formula: C20H21ClF2O4 MolecularWeight: 398.828146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=C(C=CC=C1Cl)F)(C(=O)O)O)C2=C(C=CC(=C2)F)OC

Isomeric SMILES

CC(C)(CC(CC1=C(C=CC=C1Cl)F)(C(=O)O)O)C2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C20H21ClF2O4/c1-19(2,14-9-12(22)7-8-17(14)27-3)11-20(26,18(24)25)10-13-15(21)5-4-6-16(13)23/h4-9,26H,10-11H2,1-3H3,(H,24,25)