3-(butan-2-ylamino)-5-fluoranyl-4-methyl-benzenecarbonitrile

Systemtic Name: 3-(butan-2-ylamino)-5-fluoranyl-4-methyl-benzenecarbonitrile Openeye Name: 3-fluoro-4-methyl-5-(sec-butylamino)benzonitrile CAS Name: 3-(butan-2-ylamino)-5-fluoro-4-methylbenzonitrile IUPAC Name: 3-(butan-2-ylamino)-5-fluoro-4-methylbenzonitrile Traditional Name: 3-fluoro-4-methyl-5-(sec-butylamino)benzonitrile Formula: C12H15FN2 MolecularWeight: 206.259303

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=CC(=C1)C#N)F)C

Isomeric SMILES

CCC(C)NC1=C(C(=CC(=C1)C#N)F)C

InChI

InChI=1S/C12H15FN2/c1-4-8(2)15-12-6-10(7-14)5-11(13)9(12)3/h5-6,8,15H,4H2,1-3H3