dodecylazanium; (2E,4E)-hexa-2,4-dienoate

Systemtic Name: dodecylazanium; (2E,4E)-hexa-2,4-dienoate Openeye Name: dodecylammonium; (2E,4E)-hexa-2,4-dienoate CAS Name: dodecylammonium; (2E,4E)-hexa-2,4-dienoate IUPAC Name: dodecylazanium; (2E,4E)-hexa-2,4-dienoate Traditional Name: laurylammonium sorbate Formula: C18H35NO2 MolecularWeight: 297.476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH3+].CC=CC=CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC[NH3+].C/C=C/C=C/C(=O)[O-]

InChI

InChI=1S/C12H27N.C6H8O2/c1-2-3-4-5-6-7-8-9-10-11-12-13;1-2-3-4-5-6(7)8/h2-13H2,1H3;2-5H,1H3,(H,7,8)/b;3-2+,5-4+