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

Systemtic Name: 2-(2-methoxy-3-tetradecoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]ethanamide iodide Openeye Name: 2-(2-methoxy-3-tetradecoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]acetamide iodide CAS Name: 2-(2-methoxy-3-tetradecoxyphenoxy)-N-[2-(1-methyl-3-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(2-methoxy-3-tetradecoxyphenoxy)-N-[2-(1-methylpyridin-1-ium-3-yl)ethyl]acetamide iodide Traditional Name: 2-(2-methoxy-3-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=CC(=C1OC)OCC(=O)NCCC2=C[N+](=CC=C2)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1OC)OCC(=O)NCCC2=C[N+](=CC=C2)C.[I-]

InChI

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