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

Systemtic Name: sodium (E)-4-oxidanylhenicos-2-enoate Openeye Name: sodium (E)-4-hydroxyhenicos-2-enoate CAS Name: sodium (E)-4-hydroxy-2-heneicosenoate IUPAC Name: sodium (E)-4-hydroxyhenicos-2-enoate Traditional Name: sodium (E)-4-hydroxyheneicos-2-enoate Formula: C21H39NaO3 MolecularWeight: 362.52233

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H40O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)18-19-21(23)24;/h18-20,22H,2-17H2,1H3,(H,23,24);/q;+1/p-1/b19-18+;