1-[(5S)-5-[[2-hexadecanoyloxyethyl(dimethyl)azaniumyl]methyl]oxolan-2-yl]-5-methyl-4-oxidanylidene-pyrimidin-2-olate

Systemtic Name: 1-[(5S)-5-[[2-hexadecanoyloxyethyl(dimethyl)azaniumyl]methyl]oxolan-2-yl]-5-methyl-4-oxidanylidene-pyrimidin-2-olate Openeye Name: 1-[(5S)-5-[[2-hexadecanoyloxyethyl(dimethyl)ammonio]methyl]tetrahydrofuran-2-yl]-5-methyl-4-oxo-pyrimidin-2-olate CAS Name: 1-[(5S)-5-[[dimethyl-[2-(1-oxohexadecoxy)ethyl]ammonio]methyl]-2-oxolanyl]-5-methyl-4-oxo-2-pyrimidinolate IUPAC Name: 1-[(5S)-5-[[2-hexadecanoyloxyethyl(dimethyl)azaniumyl]methyl]oxolan-2-yl]-5-methyl-4-oxopyrimidin-2-olate Traditional Name: 1-[(5S)-5-[[2-hexadecanoyloxyethyl(dimethyl)ammonio]methyl]tetrahydrofuran-2-yl]-4-keto-5-methyl-pyrimidin-2-olate Formula: C30H53N3O5 MolecularWeight: 535.75892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CC1CCC(O1)N2C=C(C(=O)N=C2[O-])C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)C[C@@H]1CCC(O1)N2C=C(C(=O)N=C2[O-])C

InChI

InChI=1S/C30H53N3O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28(34)37-22-21-33(3,4)24-26-19-20-27(38-26)32-23-25(2)29(35)31-30(32)36/h23,26-27H,5-22,24H2,1-4H3/t26-,27?/m0/s1