(E)-4-oxidanyl-2-oxidanylidene-4-[2-(phenylsulfonyl)furan-3-yl]but-3-enoic acid

Systemtic Name: (E)-4-oxidanyl-2-oxidanylidene-4-[2-(phenylsulfonyl)furan-3-yl]but-3-enoic acid Openeye Name: (E)-4-[2-(benzenesulfonyl)-3-furyl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[2-(benzenesulfonyl)-3-furanyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[2-(benzenesulfonyl)furan-3-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-(2-besyl-3-furyl)-4-hydroxy-2-keto-but-3-enoic acid Formula: C14H10O7S MolecularWeight: 322.29

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CO2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CO2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C14H10O7S/c15-11(8-12(16)13(17)18)10-6-7-21-14(10)22(19,20)9-4-2-1-3-5-9/h1-8,15H,(H,17,18)/b11-8+