3-fluoranyl-4-(4-methylpentan-2-yloxy)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-(4-methylpentan-2-yloxy)benzenecarbonitrile Openeye Name: 4-(1,3-dimethylbutoxy)-3-fluoro-benzonitrile CAS Name: 3-fluoro-4-(4-methylpentan-2-yloxy)benzonitrile IUPAC Name: 3-fluoro-4-(4-methylpentan-2-yloxy)benzonitrile Traditional Name: 4-(1,3-dimethylbutoxy)-3-fluoro-benzonitrile Formula: C13H16FNO MolecularWeight: 221.270643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)OC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CC(C)CC(C)OC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C13H16FNO/c1-9(2)6-10(3)16-13-5-4-11(8-15)7-12(13)14/h4-5,7,9-10H,6H2,1-3H3