2-azanyl-1-methyl-3-nitro-1-nitroso-2,7-dihydropurin-1-ium-6-one

Systemtic Name: 2-azanyl-1-methyl-3-nitro-1-nitroso-2,7-dihydropurin-1-ium-6-one Openeye Name: 2-amino-1-methyl-3-nitro-1-nitroso-2,7-dihydropurin-1-ium-6-one CAS Name: 2-amino-1-methyl-3-nitro-1-nitroso-2,7-dihydropurin-1-ium-6-one IUPAC Name: 2-amino-1-methyl-3-nitro-1-nitroso-2,7-dihydropurin-1-ium-6-one Traditional Name: 2-amino-1-methyl-3-nitro-1-nitroso-2,7-dihydropurin-1-ium-6-one Formula: C6H8N7O4+ MolecularWeight: 242.17222

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(N(C2=C(C1=O)NC=N2)[N+](=O)[O-])N)N=O

Isomeric SMILES

C[N+]1(C(N(C2=C(C1=O)NC=N2)[N+](=O)[O-])N)N=O

InChI

InChI=1S/C6H7N7O4/c1-13(10-15)5(14)3-4(9-2-8-3)11(6(13)7)12(16)17/h2,6H,7H2,1H3/p+1