sodium (Z)-4-oxidanylidenepent-2-en-2-olate dihydrate

Systemtic Name: sodium (Z)-4-oxidanylidenepent-2-en-2-olate dihydrate Openeye Name: sodium (Z)-4-oxopent-2-en-2-olate dihydrate CAS Name: sodium (Z)-4-oxo-2-penten-2-olate dihydrate IUPAC Name: sodium (Z)-4-oxopent-2-en-2-olate dihydrate Traditional Name: sodium (Z)-4-ketopent-2-en-2-olate dihydrate Formula: C5H11NaO4 MolecularWeight: 158.12821

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8O2.Na.2H2O/c1-4(6)3-5(2)7;;;/h3,6H,1-2H3;;2*1H2/q;+1;;/p-1/b4-3-;;;