[4-(cyanomethyl)phenyl] 4-[bis(fluoranyl)methoxy]benzoate

Systemtic Name: [4-(cyanomethyl)phenyl] 4-[bis(fluoranyl)methoxy]benzoate Openeye Name: [4-(cyanomethyl)phenyl] 4-(difluoromethoxy)benzoate CAS Name: 4-(difluoromethoxy)benzoic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] 4-(difluoromethoxy)benzoate Traditional Name: 4-(difluoromethoxy)benzoic acid [4-(cyanomethyl)phenyl] ester Formula: C16H11F2NO3 MolecularWeight: 303.260246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)OC(=O)C2=CC=C(C=C2)OC(F)F

Isomeric SMILES

C1=CC(=CC=C1CC#N)OC(=O)C2=CC=C(C=C2)OC(F)F

InChI

InChI=1S/C16H11F2NO3/c17-16(18)22-14-7-3-12(4-8-14)15(20)21-13-5-1-11(2-6-13)9-10-19/h1-8,16H,9H2