[4-(octadecoxymethyl)oxolan-2-yl]methyl N-(1-ethylpyridin-1-ium-4-yl)carbamate iodide

Systemtic Name: [4-(octadecoxymethyl)oxolan-2-yl]methyl N-(1-ethylpyridin-1-ium-4-yl)carbamate iodide Openeye Name: [4-(octadecoxymethyl)tetrahydrofuran-2-yl]methyl N-(1-ethylpyridin-1-ium-4-yl)carbamate iodide CAS Name: N-(1-ethyl-4-pyridin-1-iumyl)carbamic acid [4-(octadecoxymethyl)-2-oxolanyl]methyl ester iodide IUPAC Name: [4-(octadecoxymethyl)oxolan-2-yl]methyl N-(1-ethylpyridin-1-ium-4-yl)carbamate iodide Traditional Name: N-(1-ethylpyridin-1-ium-4-yl)carbamic acid [4-(stearyloxymethyl)tetrahydrofuran-2-yl]methyl ester iodide Formula: C32H57IN2O4 MolecularWeight: 660.71045

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC1CC(OC1)COC(=O)NC2=CC=[N+](C=C2)CC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC1CC(OC1)COC(=O)NC2=CC=[N+](C=C2)CC.[I-]

InChI

InChI=1S/C32H56N2O4.HI/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-36-26-29-25-31(37-27-29)28-38-32(35)33-30-20-22-34(4-2)23-21-30;/h20-23,29,31H,3-19,24-28H2,1-2H3;1H