sodium (E)-4-oxidanylicos-4-enoate

Systemtic Name: sodium (E)-4-oxidanylicos-4-enoate Openeye Name: sodium (E)-4-hydroxyicos-4-enoate CAS Name: sodium (E)-4-hydroxy-4-eicosenoate IUPAC Name: sodium (E)-4-hydroxyicos-4-enoate Traditional Name: sodium (E)-4-hydroxyeicos-4-enoate Formula: C20H37NaO3 MolecularWeight: 348.49575

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC=C(CCC(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C(\CCC(=O)[O-])/O.[Na+]

InChI

InChI=1S/C20H38O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(21)17-18-20(22)23;/h16,21H,2-15,17-18H2,1H3,(H,22,23);/q;+1/p-1/b19-16+;