4-(6-methyl-2-oxidanyl-heptoxy)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(6-methyl-2-oxidanyl-heptoxy)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(2-hydroxy-6-methyl-heptoxy)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(2-hydroxy-6-methylheptoxy)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(2-hydroxy-6-methylheptoxy)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(2-hydroxy-6-methyl-heptoxy)-2-(trifluoromethyl)benzonitrile Formula: C16H20F3NO2 MolecularWeight: 315.33071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(COC1=CC(=C(C=C1)C#N)C(F)(F)F)O

Isomeric SMILES

CC(C)CCCC(COC1=CC(=C(C=C1)C#N)C(F)(F)F)O

InChI

InChI=1S/C16H20F3NO2/c1-11(2)4-3-5-13(21)10-22-14-7-6-12(9-20)15(8-14)16(17,18)19/h6-8,11,13,21H,3-5,10H2,1-2H3