[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C17H12ClFN2O3 MolecularWeight: 346.740183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C(=O)OCC(=O)NC2=CC=C(C=C2)CC#N)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C(=O)OCC(=O)NC2=CC=C(C=C2)CC#N)F

InChI

InChI=1S/C17H12ClFN2O3/c18-13-2-1-3-14(19)16(13)17(23)24-10-15(22)21-12-6-4-11(5-7-12)8-9-20/h1-7H,8,10H2,(H,21,22)