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(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium

(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium

Systemtic Name:(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium
Openeye Name:(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium
CAS Name:(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium
IUPAC Name:(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium
Traditional Name:(9E,12E)-octadeca-9,12-dienoate; piperazin-1-ium
Formula: C22H42N2O2
MolecularWeight: 366.58108
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)[O-].C1CNCC[NH2+]1


Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].C1CNCC[NH2+]1


InChI

InChI=1S/C18H32O2.C4H10N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-6-4-3-5-1/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);5-6H,1-4H2/b7-6+,10-9+;


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