4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanal

Systemtic Name: 4-(5-fluoranyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanal Openeye Name: 4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal CAS Name: 4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal IUPAC Name: 4-(5-fluoro-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal Traditional Name: 4-(5-fluoro-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)valeraldehyde Formula: C14H16F4O3 MolecularWeight: 308.268653

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C=O)(C(F)(F)F)O)C1=C(C=CC(=C1)F)OC

Isomeric SMILES

CC(C)(CC(C=O)(C(F)(F)F)O)C1=C(C=CC(=C1)F)OC

InChI

InChI=1S/C14H16F4O3/c1-12(2,7-13(20,8-19)14(16,17)18)10-6-9(15)4-5-11(10)21-3/h4-6,8,20H,7H2,1-3H3