2-[3-bromanyl-4,5-bis(oxidanyl)phenyl]ethyl hydrogen sulfate

Systemtic Name: 2-[3-bromanyl-4,5-bis(oxidanyl)phenyl]ethyl hydrogen sulfate Openeye Name: 2-(3-bromo-4,5-dihydroxy-phenyl)ethyl hydrogen sulfate CAS Name: sulfuric acid 2-(3-bromo-4,5-dihydroxyphenyl)ethyl ester IUPAC Name: 2-(3-bromo-4,5-dihydroxyphenyl)ethyl hydrogen sulfate Traditional Name: sulfuric acid 2-(3-bromo-4,5-dihydroxy-phenyl)ethyl ester Formula: C8H9BrO6S MolecularWeight: 313.12246

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1O)O)Br)CCOS(=O)(=O)O

Isomeric SMILES

C1=C(C=C(C(=C1O)O)Br)CCOS(=O)(=O)O

InChI

InChI=1S/C8H9BrO6S/c9-6-3-5(4-7(10)8(6)11)1-2-15-16(12,13)14/h3-4,10-11H,1-2H2,(H,12,13,14)