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

Systemtic Name: 3,6-bis[(4-nitrophenyl)methyl]-1,2,4,5-tetrazine Openeye Name: 3,6-bis[(4-nitrophenyl)methyl]-1,2,4,5-tetrazine CAS Name: 3,6-bis[(4-nitrophenyl)methyl]-1,2,4,5-tetrazine IUPAC Name: 3,6-bis[(4-nitrophenyl)methyl]-1,2,4,5-tetrazine Traditional Name: 3,6-bis(4-nitrobenzyl)-1,2,4,5-tetrazine Formula: C16H12N6O4 MolecularWeight: 352.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NN=C(N=N2)CC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=NN=C(N=N2)CC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O4/c23-21(24)13-5-1-11(2-6-13)9-15-17-19-16(20-18-15)10-12-3-7-14(8-4-12)22(25)26/h1-8H,9-10H2