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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)F

InChI

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