2-(5-oxidanylidene-2-sulfo-furan-2-yl)ethanoic acid

Systemtic Name: 2-(5-oxidanylidene-2-sulfo-furan-2-yl)ethanoic acid Openeye Name: 2-(5-oxo-2-sulfo-2-furyl)acetic acid CAS Name: 2-(5-oxo-2-sulfo-2-furanyl)acetic acid IUPAC Name: 2-(5-oxo-2-sulfofuran-2-yl)acetic acid Traditional Name: 2-(5-keto-2-sulfo-2-furyl)acetic acid Formula: C6H6O7S MolecularWeight: 222.17264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(OC1=O)(CC(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(OC1=O)(CC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C6H6O7S/c7-4(8)3-6(14(10,11)12)2-1-5(9)13-6/h1-2H,3H2,(H,7,8)(H,10,11,12)