3-fluoranyl-4-[methyl(2-methylpropyl)amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[methyl(2-methylpropyl)amino]benzenecarbonitrile Openeye Name: 3-fluoro-4-[isobutyl(methyl)amino]benzonitrile CAS Name: 3-fluoro-4-[methyl(2-methylpropyl)amino]benzonitrile IUPAC Name: 3-fluoro-4-[methyl(2-methylpropyl)amino]benzonitrile Traditional Name: 3-fluoro-4-[isobutyl(methyl)amino]benzonitrile Formula: C12H15FN2 MolecularWeight: 206.259303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15FN2/c1-9(2)8-15(3)12-5-4-10(7-14)6-11(12)13/h4-6,9H,8H2,1-3H3