[2-[[1-(1-ethylpyridin-1-ium-2-yl)-2-oxidanylidene-propyl]carbamoyloxymethyl]oxolan-2-yl]methyl N-ethanoyl-N-octadecyl-carbamate

Systemtic Name: [2-[[1-(1-ethylpyridin-1-ium-2-yl)-2-oxidanylidene-propyl]carbamoyloxymethyl]oxolan-2-yl]methyl N-ethanoyl-N-octadecyl-carbamate Openeye Name: [2-[[1-(1-ethylpyridin-1-ium-2-yl)-2-oxo-propyl]carbamoyloxymethyl]tetrahydrofuran-2-yl]methyl N-acetyl-N-octadecyl-carbamate CAS Name: N-acetyl-N-octadecylcarbamic acid [2-[[[[1-(1-ethyl-2-pyridin-1-iumyl)-2-oxopropyl]amino]-oxomethoxy]methyl]-2-oxolanyl]methyl ester IUPAC Name: [2-[[1-(1-ethylpyridin-1-ium-2-yl)-2-oxopropyl]carbamoyloxymethyl]oxolan-2-yl]methyl N-acetyl-N-octadecylcarbamate Traditional Name: N-acetyl-N-stearyl-carbamic acid [2-[[1-(1-ethylpyridin-1-ium-2-yl)-2-keto-propyl]carbamoyloxymethyl]tetrahydrofuran-2-yl]methyl ester Formula: C38H64N3O7+ MolecularWeight: 674.93066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C(=O)C)C(=O)OCC1(CCCO1)COC(=O)NC(C2=CC=CC=[N+]2CC)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C(=O)C)C(=O)OCC1(CCCO1)COC(=O)NC(C2=CC=CC=[N+]2CC)C(=O)C

InChI

InChI=1S/C38H63N3O7/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-28-41(33(4)43)37(45)47-31-38(26-24-29-48-38)30-46-36(44)39-35(32(3)42)34-25-21-23-27-40(34)6-2/h21,23,25,27,35H,5-20,22,24,26,28-31H2,1-4H3/p+1