5-hexyl-2,4-bis(oxidanyl)benzenesulfonic acid; sodium

Systemtic Name: 5-hexyl-2,4-bis(oxidanyl)benzenesulfonic acid; sodium Openeye Name: 5-hexyl-2,4-dihydroxy-benzenesulfonic acid; sodium CAS Name: 5-hexyl-2,4-dihydroxybenzenesulfonic acid; sodium IUPAC Name: 5-hexyl-2,4-dihydroxybenzenesulfonic acid; sodium Traditional Name: 5-hexyl-2,4-dihydroxy-besylic acid; sodium Formula: C12H18NaO5S MolecularWeight: 297.32309

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1O)O)S(=O)(=O)O.[Na]

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1O)O)S(=O)(=O)O.[Na]

InChI

InChI=1S/C12H18O5S.Na/c1-2-3-4-5-6-9-7-12(18(15,16)17)11(14)8-10(9)13;/h7-8,13-14H,2-6H2,1H3,(H,15,16,17);