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

Systemtic Name: 2-(4-decoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]ethanamide iodide Openeye Name: 2-(4-decoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide iodide CAS Name: 2-(4-decoxy-3-methoxyphenyl)-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]acetamide iodide IUPAC Name: 2-(4-decoxy-3-methoxyphenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide iodide Traditional Name: 2-(4-decoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide iodide Formula: C27H41IN2O3 MolecularWeight: 568.53051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2CC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2CC)OC.[I-]

InChI

InChI=1S/C27H40N2O3.HI/c1-4-6-7-8-9-10-11-14-19-32-25-17-16-23(20-26(25)31-3)21-27(30)28-22-24-15-12-13-18-29(24)5-2;/h12-13,15-18,20H,4-11,14,19,21-22H2,1-3H3;1H