(2-chloranyl-6-fluoranyl-phenyl)methyl 3-cyanobenzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-cyanobenzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C15H9ClFNO2 MolecularWeight: 289.688863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCC2=C(C=CC=C2Cl)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCC2=C(C=CC=C2Cl)F)C#N

InChI

InChI=1S/C15H9ClFNO2/c16-13-5-2-6-14(17)12(13)9-20-15(19)11-4-1-3-10(7-11)8-18/h1-7H,9H2