3,6-bis[(4-bromophenyl)methyl]-1,2,4,5-tetrazine

Systemtic Name: 3,6-bis[(4-bromophenyl)methyl]-1,2,4,5-tetrazine Openeye Name: 3,6-bis[(4-bromophenyl)methyl]-1,2,4,5-tetrazine CAS Name: 3,6-bis[(4-bromophenyl)methyl]-1,2,4,5-tetrazine IUPAC Name: 3,6-bis[(4-bromophenyl)methyl]-1,2,4,5-tetrazine Traditional Name: 3,6-bis(4-bromobenzyl)-1,2,4,5-tetrazine Formula: C16H12Br2N4 MolecularWeight: 420.10128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NN=C(N=N2)CC3=CC=C(C=C3)Br)Br

Isomeric SMILES

C1=CC(=CC=C1CC2=NN=C(N=N2)CC3=CC=C(C=C3)Br)Br

InChI

InChI=1S/C16H12Br2N4/c17-13-5-1-11(2-6-13)9-15-19-21-16(22-20-15)10-12-3-7-14(18)8-4-12/h1-8H,9-10H2