sodium (9Z,12Z)-octadeca-9,12-dieneperoxoate

Systemtic Name: sodium (9Z,12Z)-octadeca-9,12-dieneperoxoate Openeye Name: sodium (9Z,12Z)-octadeca-9,12-dieneperoxoate CAS Name: sodium (9Z,12Z)-octadeca-9,12-dieneperoxoate IUPAC Name: sodium (9Z,12Z)-octadeca-9,12-dieneperoxoate Traditional Name: sodium (9Z,12Z)-octadeca-9,12-dieneperoxoate Formula: C18H31NaO3 MolecularWeight: 318.42671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)O[O-].[Na+]

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[O-].[Na+]

InChI

InChI=1S/C18H32O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)21-20;/h6-7,9-10,20H,2-5,8,11-17H2,1H3;/q;+1/p-1/b7-6-,10-9-;