sodium (4-propanoylphenyl) sulfate

Systemtic Name: sodium (4-propanoylphenyl) sulfate Openeye Name: sodium (4-propanoylphenyl) sulfate CAS Name: sodium [4-(1-oxopropyl)phenyl] sulfate IUPAC Name: sodium (4-propanoylphenyl) sulfate Traditional Name: sodium (4-propionylphenyl) sulfate Formula: C9H9NaO5S MolecularWeight: 252.21953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10O5S.Na/c1-2-9(10)7-3-5-8(6-4-7)14-15(11,12)13;/h3-6H,2H2,1H3,(H,11,12,13);/q;+1/p-1