4-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[2-cyanoethyl(3-pyridylmethyl)amino]-3-fluoro-benzonitrile CAS Name: 4-[2-cyanoethyl(3-pyridinylmethyl)amino]-3-fluorobenzonitrile IUPAC Name: 4-[2-cyanoethyl(pyridin-3-ylmethyl)amino]-3-fluorobenzonitrile Traditional Name: 4-[2-cyanoethyl(3-pyridylmethyl)amino]-3-fluoro-benzonitrile Formula: C16H13FN4 MolecularWeight: 280.299623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC#N)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1=CC(=CN=C1)CN(CCC#N)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C16H13FN4/c17-15-9-13(10-19)4-5-16(15)21(8-2-6-18)12-14-3-1-7-20-11-14/h1,3-5,7,9,11H,2,8,12H2