2-ethoxy-5-hexadecoxycarbonyl-benzenediazonium tetrafluoroborate

Systemtic Name: 2-ethoxy-5-hexadecoxycarbonyl-benzenediazonium tetrafluoroborate Openeye Name: 2-ethoxy-5-hexadecoxycarbonyl-benzenediazonium tetrafluoroborate CAS Name: 2-ethoxy-5-[hexadecoxy(oxo)methyl]benzenediazonium tetrafluoroborate IUPAC Name: 2-ethoxy-5-hexadecoxycarbonylbenzenediazonium tetrafluoroborate Traditional Name: 5-cetyloxycarbonyl-2-ethoxy-benzenediazonium tetrafluoroborate Formula: C25H41BF4N2O3 MolecularWeight: 504.409253

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OCC)[N+]#N

Isomeric SMILES

[B-](F)(F)(F)F.CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OCC)[N+]#N

InChI

InChI=1S/C25H41N2O3.BF4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-30-25(28)22-18-19-24(29-4-2)23(21-22)27-26;2-1(3,4)5/h18-19,21H,3-17,20H2,1-2H3;/q+1;-1