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

Systemtic Name: N-(2-methoxyphenyl)carbonyl-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide iodide Openeye Name: N-(2-methoxybenzoyl)-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide iodide CAS Name: N-[(2-methoxyphenyl)-oxomethyl]-2-methyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]-4-tetradecoxybenzamide iodide IUPAC Name: N-(2-methoxybenzoyl)-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxybenzamide iodide Traditional Name: 2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-myristyloxy-N-o-anisoyl-benzamide iodide Formula: C37H51IN2O4 MolecularWeight: 714.71631

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2C)C(=O)C3=CC=CC=C3OC)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=[N+]2C)C(=O)C3=CC=CC=C3OC)C.[I-]

InChI

InChI=1S/C37H51N2O4.HI/c1-5-6-7-8-9-10-11-12-13-14-15-20-27-43-32-24-25-33(30(2)28-32)36(40)39(29-31-21-18-19-26-38(31)3)37(41)34-22-16-17-23-35(34)42-4;/h16-19,21-26,28H,5-15,20,27,29H2,1-4H3;1H/q+1;/p-1