2-bromoethyl [3-(dodecanoylamino)-2-heptoxy-propyl] hydrogen phosphate

Systemtic Name: 2-bromoethyl [3-(dodecanoylamino)-2-heptoxy-propyl] hydrogen phosphate Openeye Name: 2-bromoethyl [3-(dodecanoylamino)-2-heptoxy-propyl] hydrogen phosphate CAS Name: 2-bromoethyl [2-heptoxy-3-(1-oxododecylamino)propyl] hydrogen phosphate IUPAC Name: 2-bromoethyl [3-(dodecanoylamino)-2-heptoxypropyl] hydrogen phosphate Traditional Name: 2-bromoethyl [2-heptoxy-3-(lauroylamino)propyl] hydrogen phosphate Formula: C24H49BrNO6P MolecularWeight: 558.526721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCCBr)OCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCCBr)OCCCCCCC

InChI

InChI=1S/C24H49BrNO6P/c1-3-5-7-9-10-11-12-13-15-17-24(27)26-21-23(30-19-16-14-8-6-4-2)22-32-33(28,29)31-20-18-25/h23H,3-22H2,1-2H3,(H,26,27)(H,28,29)