2,3-bis(4-nitrophenyl)-5-phenyl-1,3-dihydro-1,2,3,4-tetrazol-3-ium bromide

Systemtic Name: 2,3-bis(4-nitrophenyl)-5-phenyl-1,3-dihydro-1,2,3,4-tetrazol-3-ium bromide Openeye Name: 2,3-bis(4-nitrophenyl)-5-phenyl-1,3-dihydrotetrazol-3-ium bromide CAS Name: 2,3-bis(4-nitrophenyl)-5-phenyl-1,3-dihydrotetrazol-3-ium bromide IUPAC Name: 2,3-bis(4-nitrophenyl)-5-phenyl-1,3-dihydrotetrazol-3-ium bromide Traditional Name: 2,3-bis(4-nitrophenyl)-5-phenyl-1,3-dihydrotetrazol-3-ium bromide Formula: C19H15BrN6O4 MolecularWeight: 471.2642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=N[NH+](N(N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=N[NH+](N(N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C19H14N6O4.BrH/c26-24(27)17-10-6-15(7-11-17)22-20-19(14-4-2-1-3-5-14)21-23(22)16-8-12-18(13-9-16)25(28)29;/h1-13H,(H,20,21);1H