[5-(octadecoxymethyl)oxolan-3-yl]methyl N-ethanoyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: [5-(octadecoxymethyl)oxolan-3-yl]methyl N-ethanoyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: [5-(octadecoxymethyl)tetrahydrofuran-3-yl]methyl N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide CAS Name: N-acetyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]carbamic acid [5-(octadecoxymethyl)-3-oxolanyl]methyl ester iodide IUPAC Name: [5-(octadecoxymethyl)oxolan-3-yl]methyl N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide Traditional Name: N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamic acid [5-(stearyloxymethyl)tetrahydrofuran-3-yl]methyl ester iodide Formula: C34H59IN2O5 MolecularWeight: 702.74713

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC1CC(CO1)COC(=O)N(CC2=CC=CC=[N+]2C)C(=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC1CC(CO1)COC(=O)N(CC2=CC=CC=[N+]2C)C(=O)C.[I-]

InChI

InChI=1S/C34H59N2O5.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-39-29-33-25-31(27-40-33)28-41-34(38)36(30(2)37)26-32-22-19-20-23-35(32)3;/h19-20,22-23,31,33H,4-18,21,24-29H2,1-3H3;1H/q+1;/p-1