dimethyl 2-[fluoranyl-(phenylmethylsulfanyl)methylidene]propanedioate

Systemtic Name: dimethyl 2-[fluoranyl-(phenylmethylsulfanyl)methylidene]propanedioate Openeye Name: dimethyl 2-[benzylsulfanyl(fluoro)methylene]propanedioate CAS Name: 2-[fluoro-(phenylmethylthio)methylidene]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[benzylsulfanyl(fluoro)methylidene]propanedioate Traditional Name: 2-[(benzylthio)-fluoro-methylene]malonic acid dimethyl ester Formula: C13H13FO4S MolecularWeight: 284.303323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(F)SCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C(=C(F)SCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C13H13FO4S/c1-17-12(15)10(13(16)18-2)11(14)19-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3