4-(7-bromanyl-1,3-benzodioxol-4-yl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol

Systemtic Name: 4-(7-bromanyl-1,3-benzodioxol-4-yl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Openeye Name: 4-(7-bromo-1,3-benzodioxol-4-yl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol CAS Name: 4-(7-bromo-1,3-benzodioxol-4-yl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol IUPAC Name: 4-(7-bromo-1,3-benzodioxol-4-yl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Traditional Name: 4-(7-bromo-1,3-benzodioxol-4-yl)-4-methyl-2-(trifluoromethyl)pentane-1,2-diol Formula: C14H16BrF3O4 MolecularWeight: 385.17365

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CO)(C(F)(F)F)O)C1=C2C(=C(C=C1)Br)OCO2

Isomeric SMILES

CC(C)(CC(CO)(C(F)(F)F)O)C1=C2C(=C(C=C1)Br)OCO2

InChI

InChI=1S/C14H16BrF3O4/c1-12(2,5-13(20,6-19)14(16,17)18)8-3-4-9(15)11-10(8)21-7-22-11/h3-4,19-20H,5-7H2,1-2H3