5,6-bis(bromanyl)-7-methoxy-1-oxidanidyl-1,2,3,4-benzotetrazin-1-ium

Systemtic Name: 5,6-bis(bromanyl)-7-methoxy-1-oxidanidyl-1,2,3,4-benzotetrazin-1-ium Openeye Name: 5,6-dibromo-7-methoxy-1-oxido-1,2,3,4-benzotetrazin-1-ium CAS Name: 5,6-dibromo-7-methoxy-1-oxido-1,2,3,4-benzotetrazin-1-ium IUPAC Name: 5,6-dibromo-7-methoxy-1-oxido-1,2,3,4-benzotetrazin-1-ium Traditional Name: 5,6-dibromo-7-methoxy-1-oxido-1,2,3,4-benzotetrazin-1-ium Formula: C7H4Br2N4O2 MolecularWeight: 335.94026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)[N+](=NN=N2)[O-])Br)Br

Isomeric SMILES

COC1=C(C(=C2C(=C1)[N+](=NN=N2)[O-])Br)Br

InChI

InChI=1S/C7H4Br2N4O2/c1-15-4-2-3-7(6(9)5(4)8)10-11-12-13(3)14/h2H,1H3