sodium 5-methyl-5-nonyl-4-oxidanylidene-1,3-oxazol-2-olate

Systemtic Name: sodium 5-methyl-5-nonyl-4-oxidanylidene-1,3-oxazol-2-olate Openeye Name: sodium 5-methyl-5-nonyl-4-oxo-oxazol-2-olate CAS Name: sodium 5-methyl-5-nonyl-4-oxo-2-oxazololate IUPAC Name: sodium 5-methyl-5-nonyl-4-oxo-1,3-oxazol-2-olate Traditional Name: sodium 4-keto-5-methyl-5-nonyl-2-oxazolin-2-olate Formula: C13H22NNaO3 MolecularWeight: 263.30845

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(C(=O)N=C(O1)[O-])C.[Na+]

Isomeric SMILES

CCCCCCCCCC1(C(=O)N=C(O1)[O-])C.[Na+]

InChI

InChI=1S/C13H23NO3.Na/c1-3-4-5-6-7-8-9-10-13(2)11(15)14-12(16)17-13;/h3-10H2,1-2H3,(H,14,15,16);/q;+1/p-1