4-[[2-cyanoethyl(phenyl)amino]methyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[2-cyanoethyl(phenyl)amino]methyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[N-(2-cyanoethyl)anilino]methyl]-3-fluoro-benzonitrile CAS Name: 4-[[N-(2-cyanoethyl)anilino]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[N-(2-cyanoethyl)anilino]methyl]-3-fluorobenzonitrile Traditional Name: 4-[[N-(2-cyanoethyl)anilino]methyl]-3-fluoro-benzonitrile Formula: C17H14FN3 MolecularWeight: 279.311563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)CC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)CC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C17H14FN3/c18-17-11-14(12-20)7-8-15(17)13-21(10-4-9-19)16-5-2-1-3-6-16/h1-3,5-8,11H,4,10,13H2