2-[2-chloranyl-4,5-bis(oxidanyl)phenyl]-2-sulfo-ethanoic acid

Systemtic Name: 2-[2-chloranyl-4,5-bis(oxidanyl)phenyl]-2-sulfo-ethanoic acid Openeye Name: 2-(2-chloro-4,5-dihydroxy-phenyl)-2-sulfo-acetic acid CAS Name: 2-(2-chloro-4,5-dihydroxyphenyl)-2-sulfoacetic acid IUPAC Name: 2-(2-chloro-4,5-dihydroxyphenyl)-2-sulfoacetic acid Traditional Name: 2-(2-chloro-4,5-dihydroxy-phenyl)-2-sulfo-acetic acid Formula: C8H7ClO7S MolecularWeight: 282.65498

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1O)O)Cl)C(C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1O)O)Cl)C(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H7ClO7S/c9-4-2-6(11)5(10)1-3(4)7(8(12)13)17(14,15)16/h1-2,7,10-11H,(H,12,13)(H,14,15,16)