2-hydroxyethylazanium; (9E,12E)-octadeca-9,12-dienoate

Systemtic Name: 2-hydroxyethylazanium; (9E,12E)-octadeca-9,12-dienoate Openeye Name: 2-hydroxyethylammonium; (9E,12E)-octadeca-9,12-dienoate CAS Name: 2-hydroxyethylammonium; (9E,12E)-octadeca-9,12-dienoate IUPAC Name: 2-hydroxyethylazanium; (9E,12E)-octadeca-9,12-dienoate Traditional Name: 2-hydroxyethylammonium; (9E,12E)-octadeca-9,12-dienoate Formula: C20H39NO3 MolecularWeight: 341.52856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)[O-].C(CO)[NH3+]

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].C(CO)[NH3+]

InChI

InChI=1S/C18H32O2.C2H7NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;3-1-2-4/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);4H,1-3H2/b7-6+,10-9+;