sodium (Z)-1-cyano-1-isocyano-3-octoxy-3-oxidanylidene-prop-1-en-2-olate

Systemtic Name: sodium (Z)-1-cyano-1-isocyano-3-octoxy-3-oxidanylidene-prop-1-en-2-olate Openeye Name: sodium (Z)-1-cyano-1-isocyano-3-octoxy-3-oxo-prop-1-en-2-olate CAS Name: sodium (Z)-1-cyano-1-isocyano-3-octoxy-3-oxo-1-propen-2-olate IUPAC Name: sodium (Z)-1-cyano-1-isocyano-3-octoxy-3-oxoprop-1-en-2-olate Traditional Name: sodium (Z)-1-cyano-1-isocyano-3-keto-3-octoxy-prop-1-en-2-olate Formula: C13H17N2NaO3 MolecularWeight: 272.27545

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(=C(C#N)[N+]#[C-])[O-].[Na+]

Isomeric SMILES

CCCCCCCCOC(=O)/C(=C(\C#N)/[N+]#[C-])/[O-].[Na+]

InChI

InChI=1S/C13H18N2O3.Na/c1-3-4-5-6-7-8-9-18-13(17)12(16)11(10-14)15-2;/h16H,3-9H2,1H3;/q;+1/p-1/b12-11-;