N-(2-bromanyl-4-nitro-phenyl)-2,3,3,3-tetrakis(fluoranyl)-2-(trifluoromethyl)propanimidate; tetrapropylazanium

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2,3,3,3-tetrakis(fluoranyl)-2-(trifluoromethyl)propanimidate; tetrapropylazanium Openeye Name: N-(2-bromo-4-nitro-phenyl)-2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanimidate; tetrapropylammonium CAS Name: N-(2-bromo-4-nitrophenyl)-2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanimidate; tetrapropylammonium IUPAC Name: N-(2-bromo-4-nitrophenyl)-2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanimidate; tetrapropylazanium Traditional Name: N-(2-bromo-4-nitro-phenyl)-2,3,3,3-tetrafluoro-2-(trifluoromethyl)propionimidate; tetrapropylammonium Formula: C22H31BrF7N3O3 MolecularWeight: 598.392662

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CCC)(CCC)CCC.C1=CC(=C(C=C1[N+](=O)[O-])Br)N=C(C(C(F)(F)F)(C(F)(F)F)F)[O-]

Isomeric SMILES

CCC[N+](CCC)(CCC)CCC.C1=CC(=C(C=C1[N+](=O)[O-])Br)N=C(C(C(F)(F)F)(C(F)(F)F)F)[O-]

InChI

InChI=1S/C12H28N.C10H4BrF7N2O3/c1-5-9-13(10-6-2,11-7-3)12-8-4;11-5-3-4(20(22)23)1-2-6(5)19-7(21)8(12,9(13,14)15)10(16,17)18/h5-12H2,1-4H3;1-3H,(H,19,21)/q+1;/p-1