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

Systemtic Name: 2-(4-hexadecoxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]ethanamide iodide Openeye Name: 2-(4-hexadecoxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]acetamide iodide CAS Name: 2-(4-hexadecoxy-3-methoxyphenyl)-N-[(1-methyl-4-pyridin-1-iumyl)methyl]acetamide iodide IUPAC Name: 2-(4-hexadecoxy-3-methoxyphenyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]acetamide iodide Traditional Name: 2-(4-cetyloxy-3-methoxy-phenyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]acetamide iodide Formula: C32H51IN2O3 MolecularWeight: 638.66341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=[N+](C=C2)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=[N+](C=C2)C)OC.[I-]

InChI

InChI=1S/C32H50N2O3.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-37-30-19-18-29(25-31(30)36-3)26-32(35)33-27-28-20-22-34(2)23-21-28;/h18-23,25H,4-17,24,26-27H2,1-3H3;1H