6-fluoranyl-5-heptan-4-yl-cyclohexa-1,5-diene-1-carbonitrile

Systemtic Name: 6-fluoranyl-5-heptan-4-yl-cyclohexa-1,5-diene-1-carbonitrile Openeye Name: 6-fluoro-5-(1-propylbutyl)cyclohexa-1,5-diene-1-carbonitrile CAS Name: 6-fluoro-5-heptan-4-yl-1-cyclohexa-1,5-dienecarbonitrile IUPAC Name: 6-fluoro-5-heptan-4-ylcyclohexa-1,5-diene-1-carbonitrile Traditional Name: 6-fluoro-5-(1-propylbutyl)cyclohexa-1,5-diene-1-carbonitrile Formula: C14H20FN MolecularWeight: 221.313703

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1=C(C(=CCC1)C#N)F

Isomeric SMILES

CCCC(CCC)C1=C(C(=CCC1)C#N)F

InChI

InChI=1S/C14H20FN/c1-3-6-11(7-4-2)13-9-5-8-12(10-16)14(13)15/h8,11H,3-7,9H2,1-2H3