3-[(2-azanyl-5-fluoranyl-phenyl)methyl-phenyl-amino]propanenitrile

Systemtic Name: 3-[(2-azanyl-5-fluoranyl-phenyl)methyl-phenyl-amino]propanenitrile Openeye Name: 3-[N-[(2-amino-5-fluoro-phenyl)methyl]anilino]propanenitrile CAS Name: 3-[N-[(2-amino-5-fluorophenyl)methyl]anilino]propanenitrile IUPAC Name: 3-[N-[(2-amino-5-fluorophenyl)methyl]anilino]propanenitrile Traditional Name: 3-(N-(2-amino-5-fluoro-benzyl)anilino)propionitrile Formula: C16H16FN3 MolecularWeight: 269.316743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16FN3/c17-14-7-8-16(19)13(11-14)12-20(10-4-9-18)15-5-2-1-3-6-15/h1-3,5-8,11H,4,10,12,19H2