2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethyl [1-oxidanylidene-1-(3-oxidanylidenebutan-2-yloxy)propan-2-yl] phosphate

Systemtic Name: 2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethyl [1-oxidanylidene-1-(3-oxidanylidenebutan-2-yloxy)propan-2-yl] phosphate Openeye Name: 2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethyl [1-methyl-2-(1-methyl-2-oxo-propoxy)-2-oxo-ethyl] phosphate CAS Name: 2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethyl [1-oxo-1-(3-oxobutan-2-yloxy)propan-2-yl] phosphate IUPAC Name: 2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethyl [1-oxo-1-(3-oxobutan-2-yloxy)propan-2-yl] phosphate Traditional Name: 2-[2-cetyloxyethoxy(methoxy)phosphoryl]oxyethyl [2-keto-2-(2-keto-1-methyl-propoxy)-1-methyl-ethyl] phosphate Formula: C28H55O12P2- MolecularWeight: 645.676622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCOP(=O)(OC)OCCOP(=O)([O-])OC(C)C(=O)OC(C)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCOP(=O)(OC)OCCOP(=O)([O-])OC(C)C(=O)OC(C)C(=O)C

InChI

InChI=1S/C28H56O12P2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-35-21-22-37-42(33,34-5)38-24-23-36-41(31,32)40-27(4)28(30)39-26(3)25(2)29/h26-27H,6-24H2,1-5H3,(H,31,32)/p-1