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dodecyl 2-[3-(methylcarbamoyl)pyridin-1-ium-1-yl]ethanoate chloride

dodecyl 2-[3-(methylcarbamoyl)pyridin-1-ium-1-yl]ethanoate chloride

Systemtic Name:dodecyl 2-[3-(methylcarbamoyl)pyridin-1-ium-1-yl]ethanoate chloride
Openeye Name:dodecyl 2-[3-(methylcarbamoyl)pyridin-1-ium-1-yl]acetate chloride
CAS Name:2-[3-(methylcarbamoyl)-1-pyridin-1-iumyl]acetic acid dodecyl ester chloride
IUPAC Name:dodecyl 2-[3-(methylcarbamoyl)pyridin-1-ium-1-yl]acetate chloride
Traditional Name:2-[3-(methylcarbamoyl)pyridin-1-ium-1-yl]acetic acid lauryl ester chloride
Formula: C21H35ClN2O3
MolecularWeight: 398.9672
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C[N+]1=CC=CC(=C1)C(=O)NC.[Cl-]


Isomeric SMILES

CCCCCCCCCCCCOC(=O)C[N+]1=CC=CC(=C1)C(=O)NC.[Cl-]


InChI

InChI=1S/C21H34N2O3.ClH/c1-3-4-5-6-7-8-9-10-11-12-16-26-20(24)18-23-15-13-14-19(17-23)21(25)22-2;/h13-15,17H,3-12,16,18H2,1-2H3;1H


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