[2-bromoethyloxy-[2-(1,2-oxazol-3-yloxy)propoxy]phosphoryl] N-heptadecylcarbamoperoxoate

Systemtic Name: [2-bromoethyloxy-[2-(1,2-oxazol-3-yloxy)propoxy]phosphoryl] N-heptadecylcarbamoperoxoate Openeye Name: [2-bromoethoxy(2-isoxazol-3-yloxypropoxy)phosphoryl] N-heptadecylcarbamoperoxoate CAS Name: N-heptadecylcarbamoperoxoic acid [2-bromoethoxy-[2-(3-isoxazolyloxy)propoxy]phosphoryl] ester IUPAC Name: [2-bromoethoxy-[2-(1,2-oxazol-3-yloxy)propoxy]phosphoryl] N-heptadecylcarbamoperoxoate Traditional Name: N-heptadecylcarbamoperoxoic acid [2-bromoethoxy(2-isoxazol-3-yloxypropoxy)phosphoryl] ester Formula: C26H48BrN2O8P MolecularWeight: 627.545681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC(=O)OOP(=O)(OCCBr)OCC(C)OC1=NOC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC(=O)OOP(=O)(OCCBr)OCC(C)OC1=NOC=C1

InChI

InChI=1S/C26H48BrN2O8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-26(30)36-37-38(31,33-22-19-27)34-23-24(2)35-25-18-21-32-29-25/h18,21,24H,3-17,19-20,22-23H2,1-2H3,(H,28,30)