4-octoxy-3-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: 4-octoxy-3-oxidanyl-4-oxidanylidene-butanoate Openeye Name: 3-hydroxy-4-octoxy-4-oxo-butanoate CAS Name: 3-hydroxy-4-octoxy-4-oxobutanoate IUPAC Name: 3-hydroxy-4-octoxy-4-oxobutanoate Traditional Name: 3-hydroxy-4-keto-4-octoxy-butyrate Formula: C12H21O5- MolecularWeight: 245.29214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CC(=O)[O-])O

Isomeric SMILES

CCCCCCCCOC(=O)C(CC(=O)[O-])O

InChI

InChI=1S/C12H22O5/c1-2-3-4-5-6-7-8-17-12(16)10(13)9-11(14)15/h10,13H,2-9H2,1H3,(H,14,15)/p-1