sodium (Z)-2-isocyano-4-oxidanylidene-pent-2-en-3-olate

Systemtic Name: sodium (Z)-2-isocyano-4-oxidanylidene-pent-2-en-3-olate Openeye Name: sodium (Z)-2-isocyano-4-oxo-pent-2-en-3-olate CAS Name: sodium (Z)-2-isocyano-4-oxo-2-penten-3-olate IUPAC Name: sodium (Z)-2-isocyano-4-oxopent-2-en-3-olate Traditional Name: sodium (Z)-2-isocyano-4-keto-pent-2-en-3-olate Formula: C6H6NNaO2 MolecularWeight: 147.10711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H7NO2.Na/c1-4(7-3)6(9)5(2)8;/h9H,1-2H3;/q;+1/p-1/b6-4-;