3-fluoranyl-4-methyl-5-(pentylamino)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-(pentylamino)benzenecarbonitrile Openeye Name: 3-fluoro-4-methyl-5-(pentylamino)benzonitrile CAS Name: 3-fluoro-4-methyl-5-(pentylamino)benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-(pentylamino)benzonitrile Traditional Name: 3-(amylamino)-5-fluoro-4-methyl-benzonitrile Formula: C13H17FN2 MolecularWeight: 220.285883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C(=CC(=C1)C#N)F)C

Isomeric SMILES

CCCCCNC1=C(C(=CC(=C1)C#N)F)C

InChI

InChI=1S/C13H17FN2/c1-3-4-5-6-16-13-8-11(9-15)7-12(14)10(13)2/h7-8,16H,3-6H2,1-2H3