4-heptoxy-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-heptoxy-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-heptoxy-2-(trifluoromethyl)benzonitrile CAS Name: 4-heptoxy-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-heptoxy-2-(trifluoromethyl)benzonitrile Traditional Name: 4-heptoxy-2-(trifluoromethyl)benzonitrile Formula: C15H18F3NO MolecularWeight: 285.30473

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=C(C=C1)C#N)C(F)(F)F

Isomeric SMILES

CCCCCCCOC1=CC(=C(C=C1)C#N)C(F)(F)F

InChI

InChI=1S/C15H18F3NO/c1-2-3-4-5-6-9-20-13-8-7-12(11-19)14(10-13)15(16,17)18/h7-8,10H,2-6,9H2,1H3