sodium (E)-4-oxidanyloctadec-2-enoate

Systemtic Name: sodium (E)-4-oxidanyloctadec-2-enoate Openeye Name: sodium (E)-4-hydroxyoctadec-2-enoate CAS Name: sodium (E)-4-hydroxy-2-octadecenoate IUPAC Name: sodium (E)-4-hydroxyoctadec-2-enoate Traditional Name: sodium (E)-4-hydroxyoctadec-2-enoate Formula: C18H33NaO3 MolecularWeight: 320.44259

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C=CC(=O)[O-])O.[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C18H34O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21;/h15-17,19H,2-14H2,1H3,(H,20,21);/q;+1/p-1/b16-15+;