[5-(6-decoxyhexoxy)oxolan-3-yl]methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: [5-(6-decoxyhexoxy)oxolan-3-yl]methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: [5-(6-decoxyhexoxy)tetrahydrofuran-3-yl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide CAS Name: N-acetyl-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]carbamic acid [5-(6-decoxyhexoxy)-3-oxolanyl]methyl ester iodide IUPAC Name: [5-(6-decoxyhexoxy)oxolan-3-yl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Traditional Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamic acid [5-(6-decoxyhexoxy)tetrahydrofuran-3-yl]methyl ester iodide Formula: C32H55IN2O6 MolecularWeight: 690.69337

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCCCCCCOC1CC(CO1)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCOCCCCCCOC1CC(CO1)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C.[I-]

InChI

InChI=1S/C32H55N2O6.HI/c1-4-6-7-8-9-10-11-16-21-37-22-17-12-13-18-23-38-31-24-29(26-39-31)27-40-32(36)34(28(3)35)25-30-19-14-15-20-33(30)5-2;/h14-15,19-20,29,31H,4-13,16-18,21-27H2,1-3H3;1H/q+1;/p-1