(E)-4-[2-(4-fluorophenyl)sulfonyl-1H-pyrrol-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[2-(4-fluorophenyl)sulfonyl-1H-pyrrol-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[2-(4-fluorophenyl)sulfonyl-1H-pyrrol-3-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[2-(4-fluorophenyl)sulfonyl-1H-pyrrol-3-yl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[2-(4-fluorophenyl)sulfonyl-1H-pyrrol-3-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[2-(4-fluorophenyl)sulfonyl-1H-pyrrol-3-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C14H10FNO6S MolecularWeight: 339.295703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)S(=O)(=O)C2=C(C=CN2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1F)S(=O)(=O)C2=C(C=CN2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C14H10FNO6S/c15-8-1-3-9(4-2-8)23(21,22)13-10(5-6-16-13)11(17)7-12(18)14(19)20/h1-7,16-17H,(H,19,20)/b11-7+