(5-octadecoxyoxolan-3-yl)methyl N-ethanoyl-N-[(1-ethyl-2H-pyridin-1-ium-1-yl)methyl]carbamate chloride

Systemtic Name: (5-octadecoxyoxolan-3-yl)methyl N-ethanoyl-N-[(1-ethyl-2H-pyridin-1-ium-1-yl)methyl]carbamate chloride Openeye Name: (5-octadecoxytetrahydrofuran-3-yl)methyl N-acetyl-N-[(1-ethyl-2H-pyridin-1-ium-1-yl)methyl]carbamate chloride CAS Name: N-acetyl-N-[(1-ethyl-2H-pyridin-1-ium-1-yl)methyl]carbamic acid (5-octadecoxy-3-oxolanyl)methyl ester chloride IUPAC Name: (5-octadecoxyoxolan-3-yl)methyl N-acetyl-N-[(1-ethyl-2H-pyridin-1-ium-1-yl)methyl]carbamate chloride Traditional Name: N-acetyl-N-[(1-ethyl-2H-pyridin-1-ium-1-yl)methyl]carbamic acid (5-stearyloxytetrahydrofuran-3-yl)methyl ester chloride Formula: C34H61ClN2O5 MolecularWeight: 613.31154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1CC(CO1)COC(=O)N(C[N+]2(CC=CC=C2)CC)C(=O)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1CC(CO1)COC(=O)N(C[N+]2(CC=CC=C2)CC)C(=O)C.[Cl-]

InChI

InChI=1S/C34H61N2O5.ClH/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-39-33-27-32(28-40-33)29-41-34(38)35(31(3)37)30-36(5-2)24-21-20-22-25-36;/h20-22,24,32-33H,4-19,23,25-30H2,1-3H3;1H/q+1;/p-1