sodium 3,5-bis(bromanyl)-2-methyl-4-oxidanyl-benzenesulfonic acid

Systemtic Name: sodium 3,5-bis(bromanyl)-2-methyl-4-oxidanyl-benzenesulfonic acid Openeye Name: sodium 3,5-dibromo-4-hydroxy-2-methyl-benzenesulfonic acid CAS Name: sodium 3,5-dibromo-4-hydroxy-2-methylbenzenesulfonic acid IUPAC Name: sodium 3,5-dibromo-4-hydroxy-2-methylbenzenesulfonic acid Traditional Name: sodium 3,5-dibromo-4-hydroxy-2-methyl-besylic acid Formula: C7H6Br2NaO4S+ MolecularWeight: 368.98291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1S(=O)(=O)O)Br)O)Br.[Na+]

Isomeric SMILES

CC1=C(C(=C(C=C1S(=O)(=O)O)Br)O)Br.[Na+]

InChI

InChI=1S/C7H6Br2O4S.Na/c1-3-5(14(11,12)13)2-4(8)7(10)6(3)9;/h2,10H,1H3,(H,11,12,13);/q;+1