2-bromoethyl hexadecoxy 2-[(5-phenyl-1,2-oxazol-3-yl)oxy]propyl phosphate

Systemtic Name: 2-bromoethyl hexadecoxy 2-[(5-phenyl-1,2-oxazol-3-yl)oxy]propyl phosphate Openeye Name: 2-bromoethyl hexadecoxy 2-(5-phenylisoxazol-3-yl)oxypropyl phosphate CAS Name: phosphoric acid 2-bromoethyl hexadecoxy 2-[(5-phenyl-3-isoxazolyl)oxy]propyl ester IUPAC Name: 2-bromoethyl hexadecoxy 2-[(5-phenyl-1,2-oxazol-3-yl)oxy]propyl phosphate Traditional Name: phosphoric acid 2-bromoethyl cetyloxy 2-(5-phenylisoxazol-3-yl)oxypropyl ester Formula: C30H49BrNO7P MolecularWeight: 646.590321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOOP(=O)(OCCBr)OCC(C)OC1=NOC(=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCOOP(=O)(OCCBr)OCC(C)OC1=NOC(=C1)C2=CC=CC=C2

InChI

InChI=1S/C30H49BrNO7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-23-34-39-40(33,35-24-22-31)36-26-27(2)37-30-25-29(38-32-30)28-20-17-16-18-21-28/h16-18,20-21,25,27H,3-15,19,22-24,26H2,1-2H3