4-(5-bromanyl-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol

Systemtic Name: 4-(5-bromanyl-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Openeye Name: 4-(5-bromo-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol CAS Name: 4-(5-bromo-2-methoxyphenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol IUPAC Name: 4-(5-bromo-2-methoxyphenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Traditional Name: 4-(5-bromo-2-methoxy-phenyl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Formula: C14H18BrF3O3 MolecularWeight: 371.19013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrF3O3/c1-12(2,7-13(20,8-19)14(16,17)18)10-6-9(15)4-5-11(10)21-3/h4-6,19-20H,7-8H2,1-3H3