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dodecyl 1-dodecylpyridin-1-ium-4-carboxylate chloride

dodecyl 1-dodecylpyridin-1-ium-4-carboxylate chloride

Systemtic Name:dodecyl 1-dodecylpyridin-1-ium-4-carboxylate chloride
Openeye Name:dodecyl 1-dodecylpyridin-1-ium-4-carboxylate chloride
CAS Name:1-dodecyl-4-pyridin-1-iumcarboxylic acid dodecyl ester chloride
IUPAC Name:dodecyl 1-dodecylpyridin-1-ium-4-carboxylate chloride
Traditional Name:1-laurylpyridin-1-ium-4-carboxylic acid lauryl ester chloride
Formula: C30H54ClNO2
MolecularWeight: 496.20826
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=C(C=C1)C(=O)OCCCCCCCCCCCC.[Cl-]


Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=C(C=C1)C(=O)OCCCCCCCCCCCC.[Cl-]


InChI

InChI=1S/C30H54NO2.ClH/c1-3-5-7-9-11-13-15-17-19-21-25-31-26-23-29(24-27-31)30(32)33-28-22-20-18-16-14-12-10-8-6-4-2;/h23-24,26-27H,3-22,25,28H2,1-2H3;1H/q+1;/p-1


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