[(2R,5S)-2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methyl 2-quinolin-1-ium-1-ylethyl phosphate

Systemtic Name: [(2R,5S)-2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methyl 2-quinolin-1-ium-1-ylethyl phosphate Openeye Name: [(2R,5S)-2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)tetrahydrofuran-2-yl]methyl 2-quinolin-1-ium-1-ylethyl phosphate CAS Name: [(2R,5S)-2,5-dimethyl-5-[[(octadecylamino)-oxomethoxy]methyl]-2-oxolanyl]methyl 2-(1-quinolin-1-iumyl)ethyl phosphate IUPAC Name: [(2R,5S)-2,5-dimethyl-5-(octadecylcarbamoyloxymethyl)oxolan-2-yl]methyl 2-quinolin-1-ium-1-ylethyl phosphate Traditional Name: [(2R,5S)-2,5-dimethyl-5-(stearylcarbamoyloxymethyl)tetrahydrofuran-2-yl]methyl 2-quinolin-1-ium-1-ylethyl phosphate Formula: C38H63N2O7P MolecularWeight: 690.889781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCC(O1)(C)COP(=O)([O-])OCC[N+]2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OC[C@@]1(CC[C@](O1)(C)COP(=O)([O-])OCC[N+]2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C38H63N2O7P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-28-39-36(41)44-32-37(2)26-27-38(3,47-37)33-46-48(42,43)45-31-30-40-29-22-24-34-23-19-20-25-35(34)40/h19-20,22-25,29H,4-18,21,26-28,30-33H2,1-3H3,(H-,39,41,42,43)/t37-,38+/m0/s1