2-(4-bromophenyl)-6-(4-nitrophenyl)-4-phenyl-3H-1,2,4,5-tetrazin-2-ium

Systemtic Name: 2-(4-bromophenyl)-6-(4-nitrophenyl)-4-phenyl-3H-1,2,4,5-tetrazin-2-ium Openeye Name: 2-(4-bromophenyl)-6-(4-nitrophenyl)-4-phenyl-3H-1,2,4,5-tetrazin-2-ium CAS Name: 2-(4-bromophenyl)-6-(4-nitrophenyl)-4-phenyl-3H-1,2,4,5-tetrazin-2-ium IUPAC Name: 2-(4-bromophenyl)-6-(4-nitrophenyl)-4-phenyl-3H-1,2,4,5-tetrazin-2-ium Traditional Name: 2-(4-bromophenyl)-6-(4-nitrophenyl)-4-phenyl-3H-1,2,4,5-tetrazin-2-ium Formula: C20H15BrN5O2+ MolecularWeight: 437.2694

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Descriptors Computed from Structure

Canonical SMILES:

C1N(N=C(N=[N+]1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1N(N=C(N=[N+]1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H15BrN5O2/c21-16-8-12-18(13-9-16)25-14-24(17-4-2-1-3-5-17)22-20(23-25)15-6-10-19(11-7-15)26(27)28/h1-13H,14H2/q+1