7-nitro-5-[(pyrazin-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide

Systemtic Name: 7-nitro-5-[(pyrazin-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide Openeye Name: 7-nitro-5-[(pyrazin-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide CAS Name: 7-nitro-5-[(2-pyrazinylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide IUPAC Name: 7-nitro-5-[(pyrazin-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide Traditional Name: 7-nitro-5-[(pyrazin-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-quinone hydrobromide Formula: C13H11BrN6O4 MolecularWeight: 395.16824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=N1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-].Br

Isomeric SMILES

C1=CN=C(C=N1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-].Br

InChI

InChI=1S/C13H10N6O4.BrH/c20-12-13(21)18-11-7(5-16-10-6-14-1-2-15-10)3-8(19(22)23)4-9(11)17-12;/h1-4,6H,5H2,(H,15,16)(H,17,20)(H,18,21);1H