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sodium 5-methoxy-2-methyl-3-oxidanyl-benzenesulfonate

sodium 5-methoxy-2-methyl-3-oxidanyl-benzenesulfonate

Systemtic Name:sodium 5-methoxy-2-methyl-3-oxidanyl-benzenesulfonate
Openeye Name:sodium 3-hydroxy-5-methoxy-2-methyl-benzenesulfonate
CAS Name:sodium 3-hydroxy-5-methoxy-2-methylbenzenesulfonate
IUPAC Name:sodium 3-hydroxy-5-methoxy-2-methylbenzenesulfonate
Traditional Name:sodium 3-hydroxy-5-methoxy-2-methyl-besylate
Formula: C8H9NaO5S
MolecularWeight: 240.20883
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C8H10O5S.Na/c1-5-7(9)3-6(13-2)4-8(5)14(10,11)12;/h3-4,9H,1-2H3,(H,10,11,12);/q;+1/p-1


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