[2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate

Systemtic Name: [2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate Openeye Name: [2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)tetrahydrofuran-2-yl]methyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]carbamic acid [2,5-dimethyl-5-[[(octadecylamino)-oxomethoxy]methyl]-2-oxolanyl]methyl ester IUPAC Name: [2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methyl N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate Traditional Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamic acid [2,5-dimethyl-5-(stearylcarbamoyloxymethyl)tetrahydrofuran-2-yl]methyl ester Formula: C36H64N3O5+ MolecularWeight: 618.91046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCC(O1)(C)COC(=O)NCC2=CC=CC=[N+]2CC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCC(O1)(C)COC(=O)NCC2=CC=CC=[N+]2CC)C

InChI

InChI=1S/C36H63N3O5/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27-37-33(40)42-30-35(3)25-26-36(4,44-35)31-43-34(41)38-29-32-24-21-23-28-39(32)6-2/h21,23-24,28H,5-20,22,25-27,29-31H2,1-4H3,(H-,37,38,40,41)/p+1