6-nitro-7-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 6-nitro-7-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 6-nitro-7-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-1,4-dihydroquinoxaline-2,3-dione CAS Name: 6-nitro-7-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 6-nitro-7-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 6-nitro-7-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-1,4-dihydroquinoxaline-2,3-quinone Formula: C15H13N5O4 MolecularWeight: 327.29482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=CN2C3=C(C=C4C(=C3)NC(=O)C(=O)N4)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)N=CN2C3=C(C=C4C(=C3)NC(=O)C(=O)N4)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O4/c21-14-15(22)18-10-6-13(20(23)24)12(5-9(10)17-14)19-7-16-8-3-1-2-4-11(8)19/h5-7H,1-4H2,(H,17,21)(H,18,22)