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

Systemtic Name: 2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]ethanamide iodide Openeye Name: 2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]acetamide iodide CAS Name: 2-(4-decoxy-2-methoxyphenoxy)-N-[2-(1-methyl-2-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(4-decoxy-2-methoxyphenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]acetamide iodide Traditional Name: 2-(4-decoxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]acetamide iodide Formula: C27H41IN2O4 MolecularWeight: 584.52991

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=CC=[N+]2C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=CC=[N+]2C)OC.[I-]

InChI

InChI=1S/C27H40N2O4.HI/c1-4-5-6-7-8-9-10-13-20-32-24-15-16-25(26(21-24)31-3)33-22-27(30)28-18-17-23-14-11-12-19-29(23)2;/h11-12,14-16,19,21H,4-10,13,17-18,20,22H2,1-3H3;1H