3-(butylaminomethyl)-4-fluoranyl-benzenecarbonitrile

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=C(C=CC(=C1)C#N)F

Isomeric SMILES

CCCCNCC1=C(C=CC(=C1)C#N)F

InChI

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