(4-bromophenyl)methyl-methyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]azanium Traditional Name: (4-bromobenzyl)-methyl-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C17H16BrN4O3+ MolecularWeight: 404.23794

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15BrN4O3/c1-21(10-12-5-7-14(18)8-6-12)11-16-19-17(20-25-16)13-3-2-4-15(9-13)22(23)24/h2-9H,10-11H2,1H3/p+1