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

Systemtic Name: 2,4-bis(4-bromophenyl)-6-phenyl-3H-1,2,4,5-tetrazin-2-ium bromide Openeye Name: 2,4-bis(4-bromophenyl)-6-phenyl-3H-1,2,4,5-tetrazin-2-ium bromide CAS Name: 2,4-bis(4-bromophenyl)-6-phenyl-3H-1,2,4,5-tetrazin-2-ium bromide IUPAC Name: 2,4-bis(4-bromophenyl)-6-phenyl-3H-1,2,4,5-tetrazin-2-ium bromide Traditional Name: 2,4-bis(4-bromophenyl)-6-phenyl-3H-1,2,4,5-tetrazin-2-ium bromide Formula: C20H15Br3N4 MolecularWeight: 551.0719

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15Br2N4.BrH/c21-16-6-10-18(11-7-16)25-14-26(19-12-8-17(22)9-13-19)24-20(23-25)15-4-2-1-3-5-15;/h1-13H,14H2;1H/q+1;/p-1