(4-cyano-2-fluoranyl-phenyl)methyl 3-cyanobenzoate

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl 3-cyanobenzoate Openeye Name: (4-cyano-2-fluoro-phenyl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (4-cyano-2-fluorophenyl)methyl ester IUPAC Name: (4-cyano-2-fluorophenyl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (4-cyano-2-fluoro-benzyl) ester Formula: C16H9FN2O2 MolecularWeight: 280.253263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCC2=C(C=C(C=C2)C#N)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCC2=C(C=C(C=C2)C#N)F)C#N

InChI

InChI=1S/C16H9FN2O2/c17-15-7-12(9-19)4-5-14(15)10-21-16(20)13-3-1-2-11(6-13)8-18/h1-7H,10H2