methyl 4-[[4-[(E)-2-cyano-2-methylsulfonyl-ethenyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(E)-2-cyano-2-methylsulfonyl-ethenyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(E)-2-cyano-2-methylsulfonyl-vinyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-2-cyano-2-methylsulfonylethenyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-2-cyano-2-methylsulfonylethenyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-2-cyano-2-mesyl-vinyl]phenoxy]methyl]benzoic acid methyl ester Formula: C19H17NO5S MolecularWeight: 371.40698

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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)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C(\C#N)/S(=O)(=O)C

InChI

InChI=1S/C19H17NO5S/c1-24-19(21)16-7-3-15(4-8-16)13-25-17-9-5-14(6-10-17)11-18(12-20)26(2,22)23/h3-11H,13H2,1-2H3/b18-11+