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

Systemtic Name: (E)-4-[4-(4-chlorophenyl)sulfonyl-1H-pyrrol-2-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[4-(4-chlorophenyl)sulfonyl-1H-pyrrol-2-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[4-(4-chlorophenyl)sulfonyl-1H-pyrrol-2-yl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[4-(4-chlorophenyl)sulfonyl-1H-pyrrol-2-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[4-(4-chlorophenyl)sulfonyl-1H-pyrrol-2-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C14H10ClNO6S MolecularWeight: 355.7503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClNO6S/c15-8-1-3-9(4-2-8)23(21,22)10-5-11(16-7-10)12(17)6-13(18)14(19)20/h1-7,16-17H,(H,19,20)/b12-6+