4-fluoranyl-3-(3-methylbutoxymethyl)benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-(3-methylbutoxymethyl)benzenecarbonitrile Openeye Name: 4-fluoro-3-(isopentyloxymethyl)benzonitrile CAS Name: 4-fluoro-3-(3-methylbutoxymethyl)benzonitrile IUPAC Name: 4-fluoro-3-(3-methylbutoxymethyl)benzonitrile Traditional Name: 4-fluoro-3-(isoamoxymethyl)benzonitrile Formula: C13H16FNO MolecularWeight: 221.270643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOCC1=C(C=CC(=C1)C#N)F

Isomeric SMILES

CC(C)CCOCC1=C(C=CC(=C1)C#N)F

InChI

InChI=1S/C13H16FNO/c1-10(2)5-6-16-9-12-7-11(8-15)3-4-13(12)14/h3-4,7,10H,5-6,9H2,1-2H3