sodium (E)-12-oxidanyloctadec-9-enoic acid

Systemtic Name: sodium (E)-12-oxidanyloctadec-9-enoic acid Openeye Name: sodium (E)-12-hydroxyoctadec-9-enoic acid CAS Name: sodium (E)-12-hydroxy-9-octadecenoic acid IUPAC Name: sodium (E)-12-hydroxyoctadec-9-enoic acid Traditional Name: sodium (E)-12-hydroxyoctadec-9-enoic acid Formula: C18H34NaO3+ MolecularWeight: 321.45053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)O)O.[Na+]

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)O)O.[Na+]

InChI

InChI=1S/C18H34O3.Na/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;/h9,12,17,19H,2-8,10-11,13-16H2,1H3,(H,20,21);/q;+1/b12-9+;