(4-tetradecyloxolan-2-yl)methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: (4-tetradecyloxolan-2-yl)methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: (4-tetradecyltetrahydrofuran-2-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 (4-tetradecyl-2-oxolanyl)methyl ester iodide IUPAC Name: (4-tetradecyloxolan-2-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 (4-myristyltetrahydrofuran-2-yl)methyl ester iodide Formula: C30H51IN2O4 MolecularWeight: 630.64141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1CC(OC1)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCC1CC(OC1)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C.[I-]

InChI

InChI=1S/C30H51N2O4.HI/c1-4-6-7-8-9-10-11-12-13-14-15-16-19-27-22-29(35-24-27)25-36-30(34)32(26(3)33)23-28-20-17-18-21-31(28)5-2;/h17-18,20-21,27,29H,4-16,19,22-25H2,1-3H3;1H/q+1;/p-1