4-dodecoxy-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(2-methoxyphenyl)carbonyl-2-methyl-benzamide iodide

Systemtic Name: 4-dodecoxy-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(2-methoxyphenyl)carbonyl-2-methyl-benzamide iodide Openeye Name: 4-dodecoxy-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(2-methoxybenzoyl)-2-methyl-benzamide iodide CAS Name: 4-dodecoxy-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-N-[(2-methoxyphenyl)-oxomethyl]-2-methylbenzamide iodide IUPAC Name: 4-dodecoxy-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(2-methoxybenzoyl)-2-methylbenzamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-lauryloxy-2-methyl-N-o-anisoyl-benzamide iodide Formula: C36H49IN2O4 MolecularWeight: 700.68973

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3OC)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C3=CC=CC=C3OC)C.[I-]

InChI

InChI=1S/C36H49N2O4.HI/c1-5-7-8-9-10-11-12-13-14-19-26-42-31-23-24-32(29(3)27-31)35(39)38(28-30-20-17-18-25-37(30)6-2)36(40)33-21-15-16-22-34(33)41-4;/h15-18,20-25,27H,5-14,19,26,28H2,1-4H3;1H/q+1;/p-1