ethyl (2Z)-2-[(4-methylsulfonylphenyl)-phenyl-methylidene]-4-oxidanyl-butanoate

Systemtic Name: ethyl (2Z)-2-[(4-methylsulfonylphenyl)-phenyl-methylidene]-4-oxidanyl-butanoate Openeye Name: ethyl (2Z)-4-hydroxy-2-[(4-methylsulfonylphenyl)-phenyl-methylene]butanoate CAS Name: (2Z)-4-hydroxy-2-[(4-methylsulfonylphenyl)-phenylmethylidene]butanoic acid ethyl ester IUPAC Name: ethyl (2Z)-4-hydroxy-2-[(4-methylsulfonylphenyl)-phenylmethylidene]butanoate Traditional Name: (Z)-2-(2-hydroxyethyl)-3-(4-mesylphenyl)-3-phenyl-acrylic acid ethyl ester Formula: C20H22O5S MolecularWeight: 374.45068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C1=CC=CC=C1)C2=CC=C(C=C2)S(=O)(=O)C)CCO

Isomeric SMILES

CCOC(=O)/C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)S(=O)(=O)C)/CCO

InChI

InChI=1S/C20H22O5S/c1-3-25-20(22)18(13-14-21)19(15-7-5-4-6-8-15)16-9-11-17(12-10-16)26(2,23)24/h4-12,21H,3,13-14H2,1-2H3/b19-18-