(E)-4-[5-(4-chlorophenyl)sulfonylfuran-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[5-(4-chlorophenyl)sulfonylfuran-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[5-(4-chlorophenyl)sulfonyl-3-furyl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[5-(4-chlorophenyl)sulfonyl-3-furanyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[5-(4-chlorophenyl)sulfonylfuran-3-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[5-(4-chlorophenyl)sulfonyl-3-furyl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C14H9ClO7S MolecularWeight: 356.73506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)C2=CC(=CO2)C(=CC(=O)C(=O)O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)C2=CC(=CO2)/C(=C\C(=O)C(=O)O)/O)Cl

InChI

InChI=1S/C14H9ClO7S/c15-9-1-3-10(4-2-9)23(20,21)13-5-8(7-22-13)11(16)6-12(17)14(18)19/h1-7,16H,(H,18,19)/b11-6+