methyl 4-[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: methyl 4-[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: methyl 4-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethoxy]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-keto-ethoxy]-3-methoxy-benzoic acid methyl ester Formula: C20H19FN2O5 MolecularWeight: 386.373663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)N(CCC#N)C2=CC=CC=C2F

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)N(CCC#N)C2=CC=CC=C2F

InChI

InChI=1S/C20H19FN2O5/c1-26-18-12-14(20(25)27-2)8-9-17(18)28-13-19(24)23(11-5-10-22)16-7-4-3-6-15(16)21/h3-4,6-9,12H,5,11,13H2,1-2H3