sodium (Z)-4-(furan-2-yl)-2-oxidanylidene-but-3-enoate dihydrate

Systemtic Name: sodium (Z)-4-(furan-2-yl)-2-oxidanylidene-but-3-enoate dihydrate Openeye Name: sodium (Z)-4-(2-furyl)-2-oxo-but-3-enoate dihydrate CAS Name: sodium (Z)-4-(2-furanyl)-2-oxo-3-butenoate dihydrate IUPAC Name: sodium (Z)-4-(furan-2-yl)-2-oxobut-3-enoate dihydrate Traditional Name: sodium (Z)-4-(2-furyl)-2-keto-but-3-enoate dihydrate Formula: C8H9NaO6 MolecularWeight: 224.14323

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=CC(=O)C(=O)[O-].O.O.[Na+]

Isomeric SMILES

C1=COC(=C1)/C=C\C(=O)C(=O)[O-].O.O.[Na+]

InChI

InChI=1S/C8H6O4.Na.2H2O/c9-7(8(10)11)4-3-6-2-1-5-12-6;;;/h1-5H,(H,10,11);;2*1H2/q;+1;;/p-1/b4-3-;;;