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

Systemtic Name: 2-(2-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]ethanamide iodide Openeye Name: 2-(2-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]acetamide iodide CAS Name: 2-(2-methoxy-4-tetradecoxyphenoxy)-N-[2-(1-methyl-3-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(2-methoxy-4-tetradecoxyphenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]acetamide iodide Traditional Name: 2-(2-methoxy-4-myristyloxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]acetamide iodide Formula: C31H49IN2O4 MolecularWeight: 640.63623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=C[N+](=CC=C2)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=C[N+](=CC=C2)C)OC.[I-]

InChI

InChI=1S/C31H48N2O4.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-23-36-28-18-19-29(30(24-28)35-3)37-26-31(34)32-21-20-27-17-16-22-33(2)25-27;/h16-19,22,24-25H,4-15,20-21,23,26H2,1-3H3;1H