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sodium (2-ethanoyl-5-methoxy-phenyl) sulfate

sodium (2-ethanoyl-5-methoxy-phenyl) sulfate

Systemtic Name:sodium (2-ethanoyl-5-methoxy-phenyl) sulfate
Openeye Name:sodium (2-acetyl-5-methoxy-phenyl) sulfate
CAS Name:sodium (2-acetyl-5-methoxyphenyl) sulfate
IUPAC Name:sodium (2-acetyl-5-methoxyphenyl) sulfate
Traditional Name:sodium (2-acetyl-5-methoxy-phenyl) sulfate
Formula: C9H9NaO6S
MolecularWeight: 268.21893
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OC)OS(=O)(=O)[O-].[Na+]


Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OC)OS(=O)(=O)[O-].[Na+]


InChI

InChI=1S/C9H10O6S.Na/c1-6(10)8-4-3-7(14-2)5-9(8)15-16(11,12)13;/h3-5H,1-2H3,(H,11,12,13);/q;+1/p-1


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