3-oxidanylidenebutan-2-yl 2-[2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethoxy-oxidanyl-phosphoryl]oxypropanoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 2-[2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethoxy-oxidanyl-phosphoryl]oxypropanoate Openeye Name: (1-methyl-2-oxo-propyl) 2-[2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethoxy-hydroxy-phosphoryl]oxypropanoate CAS Name: 2-[2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethoxy-hydroxyphosphoryl]oxypropanoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 2-[2-[2-hexadecoxyethoxy(methoxy)phosphoryl]oxyethoxy-hydroxyphosphoryl]oxypropanoate Traditional Name: 2-[2-[2-cetyloxyethoxy(methoxy)phosphoryl]oxyethoxy-hydroxy-phosphoryl]oxypropionic acid (2-keto-1-methyl-propyl) ester Formula: C28H56O12P2 MolecularWeight: 646.684562

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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)