2-(2-chloranyl-3-tetradecoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]ethanamide iodide

Systemtic Name: 2-(2-chloranyl-3-tetradecoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]ethanamide iodide Openeye Name: 2-(2-chloro-3-tetradecoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide iodide CAS Name: 2-(2-chloro-3-tetradecoxyphenoxy)-N-[2-(1-ethyl-4-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(2-chloro-3-tetradecoxyphenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide iodide Traditional Name: 2-(2-chloro-3-myristyloxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide iodide Formula: C31H48ClIN2O3 MolecularWeight: 659.08189

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1Cl)OCC(=O)NCCC2=CC=[N+](C=C2)CC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1Cl)OCC(=O)NCCC2=CC=[N+](C=C2)CC.[I-]

InChI

InChI=1S/C31H47ClN2O3.HI/c1-3-5-6-7-8-9-10-11-12-13-14-15-25-36-28-17-16-18-29(31(28)32)37-26-30(35)33-22-19-27-20-23-34(4-2)24-21-27;/h16-18,20-21,23-24H,3-15,19,22,25-26H2,1-2H3;1H