[1-ethanoyl-3-(octadecylcarbamoyloxymethyl)azetidin-3-yl]methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate

Systemtic Name: [1-ethanoyl-3-(octadecylcarbamoyloxymethyl)azetidin-3-yl]methyl N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate Openeye Name: [1-acetyl-3-(octadecylcarbamoyloxymethyl)azetidin-3-yl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate CAS Name: N-acetyl-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]carbamic acid [1-acetyl-3-[[(octadecylamino)-oxomethoxy]methyl]-3-azetidinyl]methyl ester IUPAC Name: [1-acetyl-3-(octadecylcarbamoyloxymethyl)azetidin-3-yl]methyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate Traditional Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamic acid [1-acetyl-3-(stearylcarbamoyloxymethyl)azetidin-3-yl]methyl ester Formula: C37H63N4O6+ MolecularWeight: 659.91932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CN(C1)C(=O)C)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CN(C1)C(=O)C)COC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C

InChI

InChI=1S/C37H62N4O6/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-38-35(44)46-30-37(28-40(29-37)32(3)42)31-47-36(45)41(33(4)43)27-34-24-21-23-26-39(34)6-2/h21,23-24,26H,5-20,22,25,27-31H2,1-4H3/p+1