5-[1-azanyl-1-(1,2,3,4-tetrazol-1-yl)ethyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 5-[1-azanyl-1-(1,2,3,4-tetrazol-1-yl)ethyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 5-[1-amino-1-(tetrazol-1-yl)ethyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: 5-[1-amino-1-(1-tetrazolyl)ethyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 5-[1-amino-1-(tetrazol-1-yl)ethyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 5-[1-amino-1-(tetrazol-1-yl)ethyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C11H10N8O4 MolecularWeight: 318.2483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])(N)N3C=NN=N3

Isomeric SMILES

CC(C1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])(N)N3C=NN=N3

InChI

InChI=1S/C11H10N8O4/c1-11(12,18-4-13-16-17-18)6-2-5(19(22)23)3-7-8(6)15-10(21)9(20)14-7/h2-4H,12H2,1H3,(H,14,20)(H,15,21)