3-methoxy-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)-4-tetradecoxy-benzamide iodide

Systemtic Name: 3-methoxy-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)-4-tetradecoxy-benzamide iodide Openeye Name: N-benzoyl-3-methoxy-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxy-benzamide iodide CAS Name: N-benzoyl-3-methoxy-N-[(1-methyl-2-pyridin-1-iumyl)methyl]-4-tetradecoxybenzamide iodide IUPAC Name: N-benzoyl-3-methoxy-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-tetradecoxybenzamide iodide Traditional Name: N-benzoyl-3-methoxy-N-[(1-methylpyridin-1-ium-2-yl)methyl]-4-myristyloxy-benzamide iodide Formula: C36H49IN2O4 MolecularWeight: 700.68973

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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