(2Z)-2-[furan-2-yl-(4-methylsulfonylphenyl)methylidene]-4-oxidanyl-butanoate

Systemtic Name: (2Z)-2-[furan-2-yl-(4-methylsulfonylphenyl)methylidene]-4-oxidanyl-butanoate Openeye Name: (2Z)-2-[2-furyl-(4-methylsulfonylphenyl)methylene]-4-hydroxy-butanoate CAS Name: (2Z)-2-[2-furanyl-(4-methylsulfonylphenyl)methylidene]-4-hydroxybutanoate IUPAC Name: (2Z)-2-[furan-2-yl-(4-methylsulfonylphenyl)methylidene]-4-hydroxybutanoate Traditional Name: (Z)-3-(2-furyl)-2-(2-hydroxyethyl)-3-(4-mesylphenyl)acrylate Formula: C16H15O6S- MolecularWeight: 335.3517

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=C(CCO)C(=O)[O-])C2=CC=CO2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)/C(=C(\CCO)/C(=O)[O-])/C2=CC=CO2

InChI

InChI=1S/C16H16O6S/c1-23(20,21)12-6-4-11(5-7-12)15(14-3-2-10-22-14)13(8-9-17)16(18)19/h2-7,10,17H,8-9H2,1H3,(H,18,19)/p-1/b15-13-