sodium 5-(2-ethylbutanoyloxy)-2-oxidanyl-benzoic acid

Systemtic Name: sodium 5-(2-ethylbutanoyloxy)-2-oxidanyl-benzoic acid Openeye Name: sodium 5-(2-ethylbutanoyloxy)-2-hydroxy-benzoic acid CAS Name: sodium 5-(2-ethyl-1-oxobutoxy)-2-hydroxybenzoic acid IUPAC Name: sodium 5-(2-ethylbutanoyloxy)-2-hydroxybenzoic acid Traditional Name: sodium 5-(2-ethylbutanoyloxy)-2-hydroxy-benzoic acid Formula: C13H16NaO5+ MolecularWeight: 275.25291

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)OC1=CC(=C(C=C1)O)C(=O)O.[Na+]

Isomeric SMILES

CCC(CC)C(=O)OC1=CC(=C(C=C1)O)C(=O)O.[Na+]

InChI

InChI=1S/C13H16O5.Na/c1-3-8(4-2)13(17)18-9-5-6-11(14)10(7-9)12(15)16;/h5-8,14H,3-4H2,1-2H3,(H,15,16);/q;+1