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

Systemtic Name: N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]ethanamide iodide Openeye Name: N-(4-dodecoxy-3-methoxy-phenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]acetamide iodide CAS Name: N-(4-dodecoxy-3-methoxyphenyl)-N-[(1-ethyl-4-pyridin-1-iumyl)methyl]acetamide iodide IUPAC Name: N-(4-dodecoxy-3-methoxyphenyl)-N-[(1-ethylpyridin-1-ium-4-yl)methyl]acetamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]-N-(4-lauryloxy-3-methoxy-phenyl)acetamide iodide Formula: C29H45IN2O3 MolecularWeight: 596.58367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=[N+](C=C2)CC)C(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)N(CC2=CC=[N+](C=C2)CC)C(=O)C)OC.[I-]

InChI

InChI=1S/C29H45N2O3.HI/c1-5-7-8-9-10-11-12-13-14-15-22-34-28-17-16-27(23-29(28)33-4)31(25(3)32)24-26-18-20-30(6-2)21-19-26;/h16-21,23H,5-15,22,24H2,1-4H3;1H/q+1;/p-1