4-(3-chloranyl-4-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanal

Systemtic Name: 4-(3-chloranyl-4-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentanal Openeye Name: 4-(3-chloro-4-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal CAS Name: 4-(3-chloro-4-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal IUPAC Name: 4-(3-chloro-4-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentanal Traditional Name: 4-(3-chloro-4-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)valeraldehyde Formula: C14H16ClF3O3 MolecularWeight: 324.72325

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClF3O3/c1-12(2,7-13(20,8-19)14(16,17)18)9-4-5-11(21-3)10(15)6-9/h4-6,8,20H,7H2,1-3H3