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2-bromoethyl [2-heptadecoxy-3-(octanoylamino)propyl] hydrogen phosphate

2-bromoethyl [2-heptadecoxy-3-(octanoylamino)propyl] hydrogen phosphate

Systemtic Name:2-bromoethyl [2-heptadecoxy-3-(octanoylamino)propyl] hydrogen phosphate
Openeye Name:2-bromoethyl [2-heptadecoxy-3-(octanoylamino)propyl] hydrogen phosphate
CAS Name:2-bromoethyl [2-heptadecoxy-3-(1-oxooctylamino)propyl] hydrogen phosphate
IUPAC Name:2-bromoethyl [2-heptadecoxy-3-(octanoylamino)propyl] hydrogen phosphate
Traditional Name:2-bromoethyl [3-(caprylylamino)-2-heptadecoxy-propyl] hydrogen phosphate
Formula: C30H61BrNO6P
MolecularWeight: 642.686201
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(CNC(=O)CCCCCCC)COP(=O)(O)OCCBr


Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(CNC(=O)CCCCCCC)COP(=O)(O)OCCBr


InChI

InChI=1S/C30H61BrNO6P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-22-25-36-29(28-38-39(34,35)37-26-24-31)27-32-30(33)23-21-19-8-6-4-2/h29H,3-28H2,1-2H3,(H,32,33)(H,34,35)


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