[4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]-2-methoxy-phenyl] furan-2-carboxylate

Systemtic Name: [4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]-2-methoxy-phenyl] furan-2-carboxylate Openeye Name: [4-[(E)-2-(benzenesulfonyl)-2-cyano-vinyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(E)-2-besyl-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C21H15NO6S MolecularWeight: 409.4119

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CO3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C21H15NO6S/c1-26-20-13-15(9-10-18(20)28-21(23)19-8-5-11-27-19)12-17(14-22)29(24,25)16-6-3-2-4-7-16/h2-13H,1H3/b17-12+