2-octoxy-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-octoxy-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-octoxy-5-(trifluoromethyl)benzonitrile CAS Name: 2-octoxy-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-octoxy-5-(trifluoromethyl)benzonitrile Traditional Name: 2-octoxy-5-(trifluoromethyl)benzonitrile Formula: C16H20F3NO MolecularWeight: 299.33131

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(F)(F)F)C#N

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(F)(F)F)C#N

InChI

InChI=1S/C16H20F3NO/c1-2-3-4-5-6-7-10-21-15-9-8-14(16(17,18)19)11-13(15)12-20/h8-9,11H,2-7,10H2,1H3