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

Systemtic Name: 2-chloranyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzamide iodide Openeye Name: 2-chloro-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzamide iodide CAS Name: 2-chloro-N-[(1-methyl-2-pyridin-1-iumyl)methyl]-N-[(2-methyl-4-tetradecoxyphenyl)methyl]benzamide iodide IUPAC Name: 2-chloro-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(2-methyl-4-tetradecoxyphenyl)methyl]benzamide iodide Traditional Name: 2-chloro-N-(2-methyl-4-myristyloxy-benzyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide Formula: C36H50ClIN2O2 MolecularWeight: 705.15187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=CC=CC=[N+]2C)C(=O)C3=CC=CC=C3Cl)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=CC=CC=[N+]2C)C(=O)C3=CC=CC=C3Cl)C.[I-]

InChI

InChI=1S/C36H50ClN2O2.HI/c1-4-5-6-7-8-9-10-11-12-13-14-19-26-41-33-24-23-31(30(2)27-33)28-39(29-32-20-17-18-25-38(32)3)36(40)34-21-15-16-22-35(34)37;/h15-18,20-25,27H,4-14,19,26,28-29H2,1-3H3;1H/q+1;/p-1