3-hexadecanoyloxypropyl-dimethyl-[[5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl]azanium

Systemtic Name: 3-hexadecanoyloxypropyl-dimethyl-[[5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl]azanium Openeye Name: 3-hexadecanoyloxypropyl-[[3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl]-dimethyl-ammonium CAS Name: [3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl-dimethyl-[3-(1-oxohexadecoxy)propyl]ammonium IUPAC Name: 3-hexadecanoyloxypropyl-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-dimethylazanium Traditional Name: [5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl-(3-hexadecanoyloxypropyl)-dimethyl-ammonium Formula: C31H56N3O6+ MolecularWeight: 566.79284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCCC[N+](C)(C)CC1C(CC(O1)N2C=C(C(=O)NC2=O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCCC[N+](C)(C)CC1C(CC(O1)N2C=C(C(=O)NC2=O)C)O

InChI

InChI=1S/C31H55N3O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-29(36)39-21-18-20-34(3,4)24-27-26(35)22-28(40-27)33-23-25(2)30(37)32-31(33)38/h23,26-28,35H,5-22,24H2,1-4H3/p+1