(5-cyano-2-fluoranyl-phenyl)methyl-(furan-2-ylmethyl)-(phenylmethyl)azanium

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl-(furan-2-ylmethyl)-(phenylmethyl)azanium Openeye Name: benzyl-[(5-cyano-2-fluoro-phenyl)methyl]-(2-furylmethyl)ammonium CAS Name: (5-cyano-2-fluorophenyl)methyl-(2-furanylmethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-[(5-cyano-2-fluorophenyl)methyl]-(furan-2-ylmethyl)azanium Traditional Name: benzyl-(5-cyano-2-fluoro-benzyl)-(2-furfuryl)ammonium Formula: C20H18FN2O+ MolecularWeight: 321.368123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CC2=CC=CO2)CC3=C(C=CC(=C3)C#N)F

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CC2=CC=CO2)CC3=C(C=CC(=C3)C#N)F

InChI

InChI=1S/C20H17FN2O/c21-20-9-8-17(12-22)11-18(20)14-23(15-19-7-4-10-24-19)13-16-5-2-1-3-6-16/h1-11H,13-15H2/p+1