6-[2,3-bis(bromanyl)-1-(6-tetradecanoyloxyhexyl)piperazin-2-yl]hexyl tetradecanoate

Systemtic Name: 6-[2,3-bis(bromanyl)-1-(6-tetradecanoyloxyhexyl)piperazin-2-yl]hexyl tetradecanoate Openeye Name: 6-[2,3-dibromo-1-(6-tetradecanoyloxyhexyl)piperazin-2-yl]hexyl tetradecanoate CAS Name: tetradecanoic acid 6-[2,3-dibromo-1-[6-(1-oxotetradecoxy)hexyl]-2-piperazinyl]hexyl ester IUPAC Name: 6-[2,3-dibromo-1-(6-tetradecanoyloxyhexyl)piperazin-2-yl]hexyl tetradecanoate Traditional Name: myristic acid 6-[2,3-dibromo-1-(6-tetradecanoyloxyhexyl)piperazin-2-yl]hexyl ester Formula: C44H84Br2N2O4 MolecularWeight: 864.95676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCCCCCCC1(C(NCCN1CCCCCCOC(=O)CCCCCCCCCCCCC)Br)Br

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCCCCCCC1(C(NCCN1CCCCCCOC(=O)CCCCCCCCCCCCC)Br)Br

InChI

InChI=1S/C44H84Br2N2O4/c1-3-5-7-9-11-13-15-17-19-21-27-33-41(49)51-39-31-25-23-29-35-44(46)43(45)47-36-38-48(44)37-30-24-26-32-40-52-42(50)34-28-22-20-18-16-14-12-10-8-6-4-2/h43,47H,3-40H2,1-2H3