methyl 4-[[2-[2-cyano-2-(4-fluorophenyl)sulfonyl-ethenyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-[2-cyano-2-(4-fluorophenyl)sulfonyl-ethenyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[2-[2-cyano-2-(4-fluorophenyl)sulfonyl-vinyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-[2-cyano-2-(4-fluorophenyl)sulfonylethenyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-cyano-2-(4-fluorophenyl)sulfonylethenyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-[2-cyano-2-(4-fluorophenyl)sulfonyl-vinyl]phenoxy]methyl]benzoic acid methyl ester Formula: C24H18FNO5S MolecularWeight: 451.466823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H18FNO5S/c1-30-24(27)18-8-6-17(7-9-18)16-31-23-5-3-2-4-19(23)14-22(15-26)32(28,29)21-12-10-20(25)11-13-21/h2-14H,16H2,1H3