dimethyl (E)-2-(phenylsulfinyl)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(phenylsulfinyl)but-2-enedioate Openeye Name: dimethyl (E)-2-(benzenesulfinyl)but-2-enedioate CAS Name: (E)-2-(benzenesulfinyl)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(benzenesulfinyl)but-2-enedioate Traditional Name: (E)-2-(benzenesulfinyl)but-2-enedioic acid dimethyl ester Formula: C12H12O5S MolecularWeight: 268.28568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)S(=O)C1=CC=CC=C1

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/S(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H12O5S/c1-16-11(13)8-10(12(14)17-2)18(15)9-6-4-3-5-7-9/h3-8H,1-2H3/b10-8+