2-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]ethanamide iodide

Systemtic Name: 2-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]ethanamide iodide Openeye Name: 2-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide iodide CAS Name: 2-(4-dodecoxy-3-methoxyphenyl)-N-[(1-methyl-2-pyridin-1-iumyl)methyl]acetamide iodide IUPAC Name: 2-(4-dodecoxy-3-methoxyphenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide iodide Traditional Name: 2-(4-lauryloxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide iodide Formula: C28H43IN2O3 MolecularWeight: 582.55709

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2C)OC.[I-]

InChI

InChI=1S/C28H42N2O3.HI/c1-4-5-6-7-8-9-10-11-12-15-20-33-26-18-17-24(21-27(26)32-3)22-28(31)29-23-25-16-13-14-19-30(25)2;/h13-14,16-19,21H,4-12,15,20,22-23H2,1-3H3;1H