4-(3-chloranyl-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol

Systemtic Name: 4-(3-chloranyl-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Openeye Name: 4-(3-chloro-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol CAS Name: 4-(3-chloro-2-methoxyphenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol IUPAC Name: 4-(3-chloro-2-methoxyphenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Traditional Name: 4-(3-chloro-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Formula: C14H18ClF3O3 MolecularWeight: 326.73913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClF3O3/c1-12(2,7-13(20,8-19)14(16,17)18)9-5-4-6-10(15)11(9)21-3/h4-6,19-20H,7-8H2,1-3H3