(4-cyano-2-ethoxy-phenyl) 3-(phenylsulfonylmethyl)furan-2-carboxylate

Systemtic Name: (4-cyano-2-ethoxy-phenyl) 3-(phenylsulfonylmethyl)furan-2-carboxylate Openeye Name: (4-cyano-2-ethoxy-phenyl) 3-(benzenesulfonylmethyl)furan-2-carboxylate CAS Name: 3-(benzenesulfonylmethyl)-2-furancarboxylic acid (4-cyano-2-ethoxyphenyl) ester IUPAC Name: (4-cyano-2-ethoxyphenyl) 3-(benzenesulfonylmethyl)furan-2-carboxylate Traditional Name: 3-(besylmethyl)furan-2-carboxylic acid (4-cyano-2-ethoxy-phenyl) ester Formula: C21H17NO6S MolecularWeight: 411.42778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OC(=O)C2=C(C=CO2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OC(=O)C2=C(C=CO2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17NO6S/c1-2-26-19-12-15(13-22)8-9-18(19)28-21(23)20-16(10-11-27-20)14-29(24,25)17-6-4-3-5-7-17/h3-12H,2,14H2,1H3