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sodium 3-hexanoyloxybenzoate

sodium 3-hexanoyloxybenzoate

Systemtic Name:sodium 3-hexanoyloxybenzoate
Openeye Name:sodium 3-hexanoyloxybenzoate
CAS Name:sodium 3-(1-oxohexoxy)benzoate
IUPAC Name:sodium 3-hexanoyloxybenzoate
Traditional Name:sodium 3-caproyloxybenzoate
Formula: C13H15NaO4
MolecularWeight: 258.24557
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H16O4.Na/c1-2-3-4-8-12(14)17-11-7-5-6-10(9-11)13(15)16;/h5-7,9H,2-4,8H2,1H3,(H,15,16);/q;+1/p-1


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