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

Systemtic Name: 4-dodecoxy-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-(phenylcarbonyl)benzamide iodide Openeye Name: N-benzoyl-4-dodecoxy-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide CAS Name: N-benzoyl-4-dodecoxy-2-methyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]benzamide iodide IUPAC Name: N-benzoyl-4-dodecoxy-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide Traditional Name: N-benzoyl-4-lauryloxy-2-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]benzamide iodide Formula: C34H45IN2O3 MolecularWeight: 656.63717

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H45N2O3.HI/c1-4-5-6-7-8-9-10-11-12-18-25-39-31-22-23-32(28(2)26-31)34(38)36(27-30-21-16-17-24-35(30)3)33(37)29-19-14-13-15-20-29;/h13-17,19-24,26H,4-12,18,25,27H2,1-3H3;1H/q+1;/p-1