sodium (E)-4-butan-2-yloxy-4-oxidanylidene-but-2-enoate

Systemtic Name: sodium (E)-4-butan-2-yloxy-4-oxidanylidene-but-2-enoate Openeye Name: sodium (E)-4-oxo-4-sec-butoxy-but-2-enoate CAS Name: sodium (E)-4-butan-2-yloxy-4-oxo-2-butenoate IUPAC Name: sodium (E)-4-butan-2-yloxy-4-oxobut-2-enoate Traditional Name: sodium (E)-4-keto-4-sec-butoxy-but-2-enoate Formula: C8H11NaO4 MolecularWeight: 194.16031

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12O4.Na/c1-3-6(2)12-8(11)5-4-7(9)10;/h4-6H,3H2,1-2H3,(H,9,10);/q;+1/p-1/b5-4+;