[3-[2-[(4-methoxy-4-oxidanylidene-butanoyl)amino]ethoxy-oxidanyl-phosphoryl]oxy-2-tridecanoyloxy-propyl] cyclododecanecarboxylate

Systemtic Name: [3-[2-[(4-methoxy-4-oxidanylidene-butanoyl)amino]ethoxy-oxidanyl-phosphoryl]oxy-2-tridecanoyloxy-propyl] cyclododecanecarboxylate Openeye Name: [3-[hydroxy-[2-[(4-methoxy-4-oxo-butanoyl)amino]ethoxy]phosphoryl]oxy-2-tridecanoyloxy-propyl] cyclododecanecarboxylate CAS Name: cyclododecanecarboxylic acid [3-[hydroxy-[2-[(4-methoxy-1,4-dioxobutyl)amino]ethoxy]phosphoryl]oxy-2-(1-oxotridecoxy)propyl] ester IUPAC Name: [3-[hydroxy-[2-[(4-methoxy-4-oxobutanoyl)amino]ethoxy]phosphoryl]oxy-2-tridecanoyloxypropyl] cyclododecanecarboxylate Traditional Name: cyclododecanecarboxylic acid [3-[hydroxy-[2-[(4-keto-4-methoxy-butanoyl)amino]ethoxy]phosphoryl]oxy-2-tridecanoyloxy-propyl] ester Formula: C36H66NO11P MolecularWeight: 719.883101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OC(COC(=O)C1CCCCCCCCCCC1)COP(=O)(O)OCCNC(=O)CCC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCC(=O)OC(COC(=O)C1CCCCCCCCCCC1)COP(=O)(O)OCCNC(=O)CCC(=O)OC

InChI

InChI=1S/C36H66NO11P/c1-3-4-5-6-7-8-12-15-18-21-24-35(40)48-32(29-45-36(41)31-22-19-16-13-10-9-11-14-17-20-23-31)30-47-49(42,43)46-28-27-37-33(38)25-26-34(39)44-2/h31-32H,3-30H2,1-2H3,(H,37,38)(H,42,43)