2-bromoethyl [(2R)-3-(11-phenylundecoxy)-2-[(triphenylmethyl)amino]propyl] hydrogen phosphate

Systemtic Name: 2-bromoethyl [(2R)-3-(11-phenylundecoxy)-2-[(triphenylmethyl)amino]propyl] hydrogen phosphate Openeye Name: 2-bromoethyl [(2R)-3-(11-phenylundecoxy)-2-(tritylamino)propyl] hydrogen phosphate CAS Name: 2-bromoethyl [(2R)-3-(11-phenylundecoxy)-2-[(triphenylmethyl)amino]propyl] hydrogen phosphate IUPAC Name: 2-bromoethyl [(2R)-3-(11-phenylundecoxy)-2-(tritylamino)propyl] hydrogen phosphate Traditional Name: 2-bromoethyl [(2R)-3-(11-phenylundecoxy)-2-(tritylamino)propyl] hydrogen phosphate Formula: C41H53BrNO5P MolecularWeight: 750.740981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCCCCOCC(COP(=O)(O)OCCBr)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCCCCOC[C@H](COP(=O)(O)OCCBr)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C41H53BrNO5P/c42-31-33-47-49(44,45)48-35-40(34-46-32-21-7-5-3-1-2-4-6-12-22-36-23-13-8-14-24-36)43-41(37-25-15-9-16-26-37,38-27-17-10-18-28-38)39-29-19-11-20-30-39/h8-11,13-20,23-30,40,43H,1-7,12,21-22,31-35H2,(H,44,45)/t40-/m1/s1