(E)-4-oxidanylidene-4-(sulfomethoxy)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(sulfomethoxy)but-2-enoic acid Openeye Name: (E)-4-oxo-4-(sulfomethoxy)but-2-enoic acid CAS Name: (E)-4-oxo-4-(sulfomethoxy)-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(sulfomethoxy)but-2-enoic acid Traditional Name: (E)-4-keto-4-(sulfomethoxy)but-2-enoic acid Formula: C5H6O7S MolecularWeight: 210.16194

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Descriptors Computed from Structure

Canonical SMILES:

C(OC(=O)C=CC(=O)O)S(=O)(=O)O

Isomeric SMILES

C(OC(=O)/C=C/C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C5H6O7S/c6-4(7)1-2-5(8)12-3-13(9,10)11/h1-2H,3H2,(H,6,7)(H,9,10,11)/b2-1+