4-(4-oxidanylheptoxy)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(4-oxidanylheptoxy)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(4-hydroxyheptoxy)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(4-hydroxyheptoxy)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(4-hydroxyheptoxy)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(4-hydroxyheptoxy)-2-(trifluoromethyl)benzonitrile Formula: C15H18F3NO2 MolecularWeight: 301.30413

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCOC1=CC(=C(C=C1)C#N)C(F)(F)F)O

Isomeric SMILES

CCCC(CCCOC1=CC(=C(C=C1)C#N)C(F)(F)F)O

InChI

InChI=1S/C15H18F3NO2/c1-2-4-12(20)5-3-8-21-13-7-6-11(10-19)14(9-13)15(16,17)18/h6-7,9,12,20H,2-5,8H2,1H3