disodium 4-[(E)-hexadec-1-enoxy]-4-oxidanylidene-butanoate

Systemtic Name: disodium 4-[(E)-hexadec-1-enoxy]-4-oxidanylidene-butanoate Openeye Name: disodium 4-[(E)-hexadec-1-enoxy]-4-oxo-butanoate CAS Name: disodium 4-[(E)-hexadec-1-enoxy]-4-oxobutanoate IUPAC Name: disodium 4-[(E)-hexadec-1-enoxy]-4-oxobutanoate Traditional Name: disodium 4-[(E)-hexadec-1-enoxy]-4-keto-butyrate Formula: C20H35Na2O4+ MolecularWeight: 385.46904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=COC(=O)CCC(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/OC(=O)CCC(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C20H36O4.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-20(23)17-16-19(21)22;;/h15,18H,2-14,16-17H2,1H3,(H,21,22);;/q;2*+1/p-1/b18-15+;;