methyl 3-cyano-2-[2-[(E)-2-methylsulfonylethenyl]phenoxy]benzoate

Systemtic Name: methyl 3-cyano-2-[2-[(E)-2-methylsulfonylethenyl]phenoxy]benzoate Openeye Name: methyl 3-cyano-2-[2-[(E)-2-methylsulfonylvinyl]phenoxy]benzoate CAS Name: 3-cyano-2-[2-[(E)-2-methylsulfonylethenyl]phenoxy]benzoic acid methyl ester IUPAC Name: methyl 3-cyano-2-[2-[(E)-2-methylsulfonylethenyl]phenoxy]benzoate Traditional Name: 3-cyano-2-[2-[(E)-2-mesylvinyl]phenoxy]benzoic acid methyl ester Formula: C18H15NO5S MolecularWeight: 357.3804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1OC2=CC=CC=C2C=CS(=O)(=O)C)C#N

Isomeric SMILES

COC(=O)C1=CC=CC(=C1OC2=CC=CC=C2/C=C/S(=O)(=O)C)C#N

InChI

InChI=1S/C18H15NO5S/c1-23-18(20)15-8-5-7-14(12-19)17(15)24-16-9-4-3-6-13(16)10-11-25(2,21)22/h3-11H,1-2H3/b11-10+