(4-cyano-2-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: (4-cyano-2-fluoro-phenyl)methyl-(3-pyridylmethyl)ammonium CAS Name: (4-cyano-2-fluorophenyl)methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (4-cyano-2-fluorophenyl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: (4-cyano-2-fluoro-benzyl)-(3-pyridylmethyl)ammonium Formula: C14H13FN3+ MolecularWeight: 242.271523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C[NH2+]CC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1=CC(=CN=C1)C[NH2+]CC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C14H12FN3/c15-14-6-11(7-16)3-4-13(14)10-18-9-12-2-1-5-17-8-12/h1-6,8,18H,9-10H2/p+1