4-(2-hydroxyethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride

Systemtic Name: 4-(2-hydroxyethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride Openeye Name: 4-(2-hydroxyethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride CAS Name: 4-(2-hydroxyethyl)-6-(1-imidazolyl)-7-nitro-1H-quinoxaline-2,3-dione hydrochloride IUPAC Name: 4-(2-hydroxyethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione hydrochloride Traditional Name: 4-(2-hydroxyethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-quinone hydrochloride Formula: C13H12ClN5O5 MolecularWeight: 353.71788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=C(C=C3C(=C2)N(C(=O)C(=O)N3)CCO)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CN(C=N1)C2=C(C=C3C(=C2)N(C(=O)C(=O)N3)CCO)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H11N5O5.ClH/c19-4-3-17-9-6-10(16-2-1-14-7-16)11(18(22)23)5-8(9)15-12(20)13(17)21;/h1-2,5-7,19H,3-4H2,(H,15,20);1H