(3R,4R)-2,2-dimethyl-7-phenylmethoxy-4-(trifluoromethyl)hept-5-yn-3-ol

Systemtic Name: (3R,4R)-2,2-dimethyl-7-phenylmethoxy-4-(trifluoromethyl)hept-5-yn-3-ol Openeye Name: (3R,4R)-7-benzyloxy-2,2-dimethyl-4-(trifluoromethyl)hept-5-yn-3-ol CAS Name: (3R,4R)-2,2-dimethyl-7-phenylmethoxy-4-(trifluoromethyl)-5-heptyn-3-ol IUPAC Name: (3R,4R)-2,2-dimethyl-7-phenylmethoxy-4-(trifluoromethyl)hept-5-yn-3-ol Traditional Name: (3R,4R)-7-benzoxy-2,2-dimethyl-4-(trifluoromethyl)hept-5-yn-3-ol Formula: C17H21F3O2 MolecularWeight: 314.34265

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(C#CCOCC1=CC=CC=C1)C(F)(F)F)O

Isomeric SMILES

CC(C)(C)[C@@H]([C@@H](C#CCOCC1=CC=CC=C1)C(F)(F)F)O

InChI

InChI=1S/C17H21F3O2/c1-16(2,3)15(21)14(17(18,19)20)10-7-11-22-12-13-8-5-4-6-9-13/h4-6,8-9,14-15,21H,11-12H2,1-3H3/t14-,15-/m1/s1