calcium potassium (2E,4E)-hexa-2,4-dienoate sulfate

Systemtic Name: calcium potassium (2E,4E)-hexa-2,4-dienoate sulfate Openeye Name: calcium potassium (2E,4E)-hexa-2,4-dienoate sulfate CAS Name: calcium potassium (2E,4E)-hexa-2,4-dienoate sulfate IUPAC Name: calcium potassium (2E,4E)-hexa-2,4-dienoate sulfate Traditional Name: calcium potassium sorbate sulfate Formula: C6H7CaKO6S MolecularWeight: 286.35748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O2.Ca.K.H2O4S/c1-2-3-4-5-6(7)8;;;1-5(2,3)4/h2-5H,1H3,(H,7,8);;;(H2,1,2,3,4)/q;+2;+1;/p-3/b3-2+,5-4+;;;