3-fluoranyl-4-(2-methylbutan-2-yloxymethyl)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-(2-methylbutan-2-yloxymethyl)benzenecarbonitrile Openeye Name: 4-(1,1-dimethylpropoxymethyl)-3-fluoro-benzonitrile CAS Name: 3-fluoro-4-(2-methylbutan-2-yloxymethyl)benzonitrile IUPAC Name: 3-fluoro-4-(2-methylbutan-2-yloxymethyl)benzonitrile Traditional Name: 4-(tert-amyloxymethyl)-3-fluoro-benzonitrile Formula: C13H16FNO MolecularWeight: 221.270643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OCC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CCC(C)(C)OCC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C13H16FNO/c1-4-13(2,3)16-9-11-6-5-10(8-15)7-12(11)14/h5-7H,4,9H2,1-3H3