6-(5-fluoranyl-2-methoxy-phenyl)-6-methyl-4-(trifluoromethyl)hept-1-yn-4-ol

Systemtic Name: 6-(5-fluoranyl-2-methoxy-phenyl)-6-methyl-4-(trifluoromethyl)hept-1-yn-4-ol Openeye Name: 6-(5-fluoro-2-methoxy-phenyl)-6-methyl-4-(trifluoromethyl)hept-1-yn-4-ol CAS Name: 6-(5-fluoro-2-methoxyphenyl)-6-methyl-4-(trifluoromethyl)-1-heptyn-4-ol IUPAC Name: 6-(5-fluoro-2-methoxyphenyl)-6-methyl-4-(trifluoromethyl)hept-1-yn-4-ol Traditional Name: 6-(5-fluoro-2-methoxy-phenyl)-6-methyl-4-(trifluoromethyl)hept-1-yn-4-ol Formula: C16H18F4O2 MolecularWeight: 318.306533

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18F4O2/c1-5-8-15(21,16(18,19)20)10-14(2,3)12-9-11(17)6-7-13(12)22-4/h1,6-7,9,21H,8,10H2,2-4H3