calcium; (2E,4E)-hexa-2,4-dienoate; (2E,4E)-hexa-2,4-dienoic acid

Systemtic Name: calcium; (2E,4E)-hexa-2,4-dienoate; (2E,4E)-hexa-2,4-dienoic acid Openeye Name: calcium; (2E,4E)-hexa-2,4-dienoate; (2E,4E)-hexa-2,4-dienoic acid CAS Name: calcium; (2E,4E)-hexa-2,4-dienoate; (2E,4E)-hexa-2,4-dienoic acid IUPAC Name: calcium; (2E,4E)-hexa-2,4-dienoate; (2E,4E)-hexa-2,4-dienoic acid Traditional Name: calcium (2E,4E)-hexa-2,4-dienoic acid sorbate Formula: C12H15CaO4+ MolecularWeight: 263.3231

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H8O2.Ca/c2*1-2-3-4-5-6(7)8;/h2*2-5H,1H3,(H,7,8);/q;;+2/p-1/b2*3-2+,5-4+;