2-hexoxy-4-[hexyl-[1-(4-methoxyphenoxy)propan-2-yl]amino]benzenediazonium hexafluorophosphate

Systemtic Name: 2-hexoxy-4-[hexyl-[1-(4-methoxyphenoxy)propan-2-yl]amino]benzenediazonium hexafluorophosphate Openeye Name: 2-hexoxy-4-[hexyl-[2-(4-methoxyphenoxy)-1-methyl-ethyl]amino]benzenediazonium hexafluorophosphate CAS Name: 2-hexoxy-4-[hexyl-[1-(4-methoxyphenoxy)propan-2-yl]amino]benzenediazonium hexafluorophosphate IUPAC Name: 2-hexoxy-4-[hexyl-[1-(4-methoxyphenoxy)propan-2-yl]amino]benzenediazonium hexafluorophosphate Traditional Name: 2-hexoxy-4-[hexyl-[2-(4-methoxyphenoxy)-1-methyl-ethyl]amino]benzenediazonium hexafluorophosphate Formula: C28H42F6N3O3P MolecularWeight: 613.61556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C1=CC(=C(C=C1)[N+]#N)OCCCCCC)C(C)COC2=CC=C(C=C2)OC.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CCCCCCN(C1=CC(=C(C=C1)[N+]#N)OCCCCCC)C(C)COC2=CC=C(C=C2)OC.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C28H42N3O3.F6P/c1-5-7-9-11-19-31(23(3)22-34-26-16-14-25(32-4)15-17-26)24-13-18-27(30-29)28(21-24)33-20-12-10-8-6-2;1-7(2,3,4,5)6/h13-18,21,23H,5-12,19-20,22H2,1-4H3;/q+1;-1