bis(oxidanyl)-oxidanylidene-azanium; 1-[2-(4-bromophenyl)octyl]imidazole

Systemtic Name: bis(oxidanyl)-oxidanylidene-azanium; 1-[2-(4-bromophenyl)octyl]imidazole Openeye Name: 1-[2-(4-bromophenyl)octyl]imidazole; dihydroxy(oxo)ammonium CAS Name: 1-[2-(4-bromophenyl)octyl]imidazole; dihydroxy(oxo)ammonium IUPAC Name: 1-[2-(4-bromophenyl)octyl]imidazole; dihydroxy(oxo)azanium Traditional Name: 1-[2-(4-bromophenyl)octyl]imidazole; dihydroxy(keto)ammonium Formula: C17H25BrN3O3+ MolecularWeight: 399.3027

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CN1C=CN=C1)C2=CC=C(C=C2)Br.[N+](=O)(O)O

Isomeric SMILES

CCCCCCC(CN1C=CN=C1)C2=CC=C(C=C2)Br.[N+](=O)(O)O

InChI

InChI=1S/C17H23BrN2.H2NO3/c1-2-3-4-5-6-16(13-20-12-11-19-14-20)15-7-9-17(18)10-8-15;2-1(3)4/h7-12,14,16H,2-6,13H2,1H3;(H2,2,3,4)/q;+1