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dimethyl-[(E)-octadec-9-enoyl]-[(E)-1-oxidanyl-3-oxidanylidene-icos-11-enyl]azanium bromide
dimethyl-[(E)-octadec-9-enoyl]-[(E)-1-oxidanyl-3-oxidanylidene-icos-11-enyl]azanium bromide
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Canonical SMILES:
CCCCCCCCC=CCCCCCCCC(=O)CC([N+](C)(C)C(=O)CCCCCCCC=CCCCCCCCC)O.[Br-]
Isomeric SMILES
CCCCCCCC/C=C/CCCCCCCC(=O)CC([N+](C)(C)C(=O)CCCCCCC/C=C/CCCCCCCC)O.[Br-]
InChI
InChI=1S/C40H76NO3.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38(42)37-40(44)41(3,4)39(43)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h19-22,40,44H,5-18,23-37H2,1-4H3;1H/q+1;/p-1/b21-19+,22-20+;

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