3-fluoranyl-4-methyl-5-(pentan-3-ylamino)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-(pentan-3-ylamino)benzenecarbonitrile Openeye Name: 3-(1-ethylpropylamino)-5-fluoro-4-methyl-benzonitrile CAS Name: 3-fluoro-4-methyl-5-(pentan-3-ylamino)benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-(pentan-3-ylamino)benzonitrile Traditional Name: 3-(1-ethylpropylamino)-5-fluoro-4-methyl-benzonitrile Formula: C13H17FN2 MolecularWeight: 220.285883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17FN2/c1-4-11(5-2)16-13-7-10(8-15)6-12(14)9(13)3/h6-7,11,16H,4-5H2,1-3H3