3-[(2E)-2-[ethoxy(oxidanyl)methylidene]-3-oxidanylidene-butanoyl]benzenesulfonyl fluoride

Systemtic Name: 3-[(2E)-2-[ethoxy(oxidanyl)methylidene]-3-oxidanylidene-butanoyl]benzenesulfonyl fluoride Openeye Name: 3-[(2E)-2-[ethoxy(hydroxy)methylene]-3-oxo-butanoyl]benzenesulfonyl fluoride CAS Name: 3-[(2E)-2-[ethoxy(hydroxy)methylidene]-1,3-dioxobutyl]benzenesulfonyl fluoride IUPAC Name: 3-[(2E)-2-[ethoxy(hydroxy)methylidene]-3-oxobutanoyl]benzenesulfonyl fluoride Traditional Name: 3-[(E)-2-acetyl-3-ethoxy-3-hydroxy-acryloyl]benzenesulfonyl fluoride Formula: C13H13FO6S MolecularWeight: 316.302123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C)C(=O)C1=CC(=CC=C1)S(=O)(=O)F)O

Isomeric SMILES

CCO/C(=C(\C(=O)C)/C(=O)C1=CC(=CC=C1)S(=O)(=O)F)/O

InChI

InChI=1S/C13H13FO6S/c1-3-20-13(17)11(8(2)15)12(16)9-5-4-6-10(7-9)21(14,18)19/h4-7,17H,3H2,1-2H3/b13-11+