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

Systemtic Name: [4-(octadecoxymethyl)oxolan-2-yl]methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]carbamate iodide Openeye Name: [4-(octadecoxymethyl)tetrahydrofuran-2-yl]methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]carbamate iodide CAS Name: N-[(1-ethyl-4-pyridin-1-iumyl)methyl]carbamic acid [4-(octadecoxymethyl)-2-oxolanyl]methyl ester iodide IUPAC Name: [4-(octadecoxymethyl)oxolan-2-yl]methyl N-[(1-ethylpyridin-1-ium-4-yl)methyl]carbamate iodide Traditional Name: N-[(1-ethylpyridin-1-ium-4-yl)methyl]carbamic acid [4-(stearyloxymethyl)tetrahydrofuran-2-yl]methyl ester iodide Formula: C33H59IN2O4 MolecularWeight: 674.73703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC1CC(OC1)COC(=O)NCC2=CC=[N+](C=C2)CC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC1CC(OC1)COC(=O)NCC2=CC=[N+](C=C2)CC.[I-]

InChI

InChI=1S/C33H58N2O4.HI/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-37-27-31-25-32(38-28-31)29-39-33(36)34-26-30-20-22-35(4-2)23-21-30;/h20-23,31-32H,3-19,24-29H2,1-2H3;1H