5-[1,3-dihydroimidazol-2-ylidene(oxidanyl)methyl]-3-nitro-cyclohexa-3,5-diene-1,2-dione hydrobromide

Systemtic Name: 5-[1,3-dihydroimidazol-2-ylidene(oxidanyl)methyl]-3-nitro-cyclohexa-3,5-diene-1,2-dione hydrobromide Openeye Name: 5-[1,3-dihydroimidazol-2-ylidene(hydroxy)methyl]-3-nitro-1,2-benzoquinone hydrobromide CAS Name: 5-[1,3-dihydroimidazol-2-ylidene(hydroxy)methyl]-3-nitrocyclohexa-3,5-diene-1,2-dione hydrobromide IUPAC Name: 5-[1,3-dihydroimidazol-2-ylidene(hydroxy)methyl]-3-nitrocyclohexa-3,5-diene-1,2-dione hydrobromide Traditional Name: 5-[hydroxy(4-imidazolin-2-ylidene)methyl]-3-nitro-o-benzoquinone hydrobromide Formula: C10H8BrN3O5 MolecularWeight: 330.09162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C(C2=CC(=O)C(=O)C(=C2)[N+](=O)[O-])O)N1.Br

Isomeric SMILES

C1=CNC(=C(C2=CC(=O)C(=O)C(=C2)[N+](=O)[O-])O)N1.Br

InChI

InChI=1S/C10H7N3O5.BrH/c14-7-4-5(3-6(9(7)16)13(17)18)8(15)10-11-1-2-12-10;/h1-4,11-12,15H;1H