3-fluoranyl-4-(3-methylbutylamino)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-(3-methylbutylamino)benzenecarbonitrile Openeye Name: 3-fluoro-4-(isopentylamino)benzonitrile CAS Name: 3-fluoro-4-(3-methylbutylamino)benzonitrile IUPAC Name: 3-fluoro-4-(3-methylbutylamino)benzonitrile Traditional Name: 3-fluoro-4-(isoamylamino)benzonitrile Formula: C12H15FN2 MolecularWeight: 206.259303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CC(C)CCNC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C12H15FN2/c1-9(2)5-6-15-12-4-3-10(8-14)7-11(12)13/h3-4,7,9,15H,5-6H2,1-2H3