4-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(3-tetradecoxyphenyl)methyl]benzenesulfonamide iodide

Systemtic Name: 4-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(3-tetradecoxyphenyl)methyl]benzenesulfonamide iodide Openeye Name: 4-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(3-tetradecoxyphenyl)methyl]benzenesulfonamide iodide CAS Name: 4-methyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]-N-[(3-tetradecoxyphenyl)methyl]benzenesulfonamide iodide IUPAC Name: 4-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-[(3-tetradecoxyphenyl)methyl]benzenesulfonamide iodide Traditional Name: 4-methyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]-N-(3-myristyloxybenzyl)benzenesulfonamide iodide Formula: C35H51IN2O3S MolecularWeight: 706.76051

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H51N2O3S.HI/c1-4-5-6-7-8-9-10-11-12-13-14-17-27-40-34-21-18-19-32(28-34)29-37(30-33-20-15-16-26-36(33)3)41(38,39)35-24-22-31(2)23-25-35;/h15-16,18-26,28H,4-14,17,27,29-30H2,1-3H3;1H/q+1;/p-1