(E)-4-[2-(4-chlorophenyl)sulfonyl-1,3-thiazol-4-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[2-(4-chlorophenyl)sulfonyl-1,3-thiazol-4-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[2-(4-chlorophenyl)sulfonylthiazol-4-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[2-(4-chlorophenyl)sulfonyl-4-thiazolyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[2-(4-chlorophenyl)sulfonyl-1,3-thiazol-4-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[2-(4-chlorophenyl)sulfonylthiazol-4-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C13H8ClNO6S2 MolecularWeight: 373.78872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)C2=NC(=CS2)C(=CC(=O)C(=O)O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)C2=NC(=CS2)/C(=C\C(=O)C(=O)O)/O)Cl

InChI

InChI=1S/C13H8ClNO6S2/c14-7-1-3-8(4-2-7)23(20,21)13-15-9(6-22-13)10(16)5-11(17)12(18)19/h1-6,16H,(H,18,19)/b10-5+