2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]ethanamide iodide

Systemtic Name: 2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]ethanamide iodide Openeye Name: 2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide iodide CAS Name: 2-(4-decoxy-2-methoxyphenoxy)-N-[2-(1-ethyl-4-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(4-decoxy-2-methoxyphenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide iodide Traditional Name: 2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide iodide Formula: C28H43IN2O4 MolecularWeight: 598.55649

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=[N+](C=C2)CC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=[N+](C=C2)CC)OC.[I-]

InChI

InChI=1S/C28H42N2O4.HI/c1-4-6-7-8-9-10-11-12-21-33-25-13-14-26(27(22-25)32-3)34-23-28(31)29-18-15-24-16-19-30(5-2)20-17-24;/h13-14,16-17,19-20,22H,4-12,15,18,21,23H2,1-3H3;1H