calcium (2E,4E)-hexa-2,4-dienoate ethanoate

Systemtic Name: calcium (2E,4E)-hexa-2,4-dienoate ethanoate Openeye Name: calcium (2E,4E)-hexa-2,4-dienoate acetate CAS Name: calcium (2E,4E)-hexa-2,4-dienoate acetate IUPAC Name: calcium (2E,4E)-hexa-2,4-dienoate acetate Traditional Name: calcium acetate sorbate Formula: C8H10CaO4 MolecularWeight: 210.2406

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)[O-].CC(=O)[O-].[Ca+2]

Isomeric SMILES

C/C=C/C=C/C(=O)[O-].CC(=O)[O-].[Ca+2]

InChI

InChI=1S/C6H8O2.C2H4O2.Ca/c1-2-3-4-5-6(7)8;1-2(3)4;/h2-5H,1H3,(H,7,8);1H3,(H,3,4);/q;;+2/p-2/b3-2+,5-4+;;