2-bromoethyl [3-(octadecanoylamino)-2-tridecoxy-propyl] hydrogen phosphate

Systemtic Name: 2-bromoethyl [3-(octadecanoylamino)-2-tridecoxy-propyl] hydrogen phosphate Openeye Name: 2-bromoethyl [3-(octadecanoylamino)-2-tridecoxy-propyl] hydrogen phosphate CAS Name: 2-bromoethyl [3-(1-oxooctadecylamino)-2-tridecoxypropyl] hydrogen phosphate IUPAC Name: 2-bromoethyl [3-(octadecanoylamino)-2-tridecoxypropyl] hydrogen phosphate Traditional Name: 2-bromoethyl (3-stearamido-2-tridecoxy-propyl) hydrogen phosphate Formula: C36H73BrNO6P MolecularWeight: 726.845681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCCBr)OCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC(COP(=O)(O)OCCBr)OCCCCCCCCCCCCC

InChI

InChI=1S/C36H73BrNO6P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-36(39)38-33-35(34-44-45(40,41)43-32-30-37)42-31-28-26-24-22-20-14-12-10-8-6-4-2/h35H,3-34H2,1-2H3,(H,38,39)(H,40,41)