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

Systemtic Name: 3-chloranyl-4-dodecoxy-N-(2-methoxyphenyl)carbonyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide Openeye Name: 3-chloro-4-dodecoxy-N-(2-methoxybenzoyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide CAS Name: 3-chloro-4-dodecoxy-N-[(2-methoxyphenyl)-oxomethyl]-N-[(1-methyl-2-pyridin-1-iumyl)methyl]benzamide iodide IUPAC Name: 3-chloro-4-dodecoxy-N-(2-methoxybenzoyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide Traditional Name: 3-chloro-4-lauryloxy-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-o-anisoyl-benzamide iodide Formula: C34H44ClIN2O4 MolecularWeight: 707.08163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H44ClN2O4.HI/c1-4-5-6-7-8-9-10-11-12-17-24-41-32-22-21-27(25-30(32)35)33(38)37(26-28-18-15-16-23-36(28)2)34(39)29-19-13-14-20-31(29)40-3;/h13-16,18-23,25H,4-12,17,24,26H2,1-3H3;1H/q+1;/p-1