(9E,12E)-octadeca-9,12-dienoate; trimethylazanium

Systemtic Name: (9E,12E)-octadeca-9,12-dienoate; trimethylazanium Openeye Name: (9E,12E)-octadeca-9,12-dienoate; trimethylammonium CAS Name: (9E,12E)-octadeca-9,12-dienoate; trimethylammonium IUPAC Name: (9E,12E)-octadeca-9,12-dienoate; trimethylazanium Traditional Name: (9E,12E)-octadeca-9,12-dienoate; trimethylammonium Formula: C21H41NO2 MolecularWeight: 339.55574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H32O2.C3H9N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-4(2)3/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);1-3H3/b7-6+,10-9+;