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dodecyl 1-methylpyridin-1-ium-3-carboxylate

dodecyl 1-methylpyridin-1-ium-3-carboxylate

Systemtic Name:dodecyl 1-methylpyridin-1-ium-3-carboxylate
Openeye Name:dodecyl 1-methylpyridin-1-ium-3-carboxylate
CAS Name:1-methyl-3-pyridin-1-iumcarboxylic acid dodecyl ester
IUPAC Name:dodecyl 1-methylpyridin-1-ium-3-carboxylate
Traditional Name:1-methylpyridin-1-ium-3-carboxylic acid lauryl ester
Formula: C19H32NO2+
MolecularWeight: 306.46288
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=C[N+](=CC=C1)C


Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=C[N+](=CC=C1)C


InChI

InChI=1S/C19H32NO2/c1-3-4-5-6-7-8-9-10-11-12-16-22-19(21)18-14-13-15-20(2)17-18/h13-15,17H,3-12,16H2,1-2H3/q+1


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