6-[2-(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinyl]-5-nitro-pyrimidin-4-amine hydrate

Systemtic Name: 6-[2-(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinyl]-5-nitro-pyrimidin-4-amine hydrate Openeye Name: 6-[2-(6-amino-5-nitro-pyrimidin-4-yl)hydrazino]-5-nitro-pyrimidin-4-amine hydrate CAS Name: 6-[(6-amino-5-nitro-4-pyrimidinyl)hydrazo]-5-nitro-4-pyrimidinamine hydrate IUPAC Name: 6-[2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl]-5-nitropyrimidin-4-amine hydrate Traditional Name: [6-[N'-(6-amino-5-nitro-pyrimidin-4-yl)hydrazino]-5-nitro-pyrimidin-4-yl]amine hydrate Formula: C8H10N10O5 MolecularWeight: 326.229

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(C(=N1)NNC2=NC=NC(=C2[N+](=O)[O-])N)[N+](=O)[O-])N.O

Isomeric SMILES

C1=NC(=C(C(=N1)NNC2=NC=NC(=C2[N+](=O)[O-])N)[N+](=O)[O-])N.O

InChI

InChI=1S/C8H8N10O4.H2O/c9-5-3(17(19)20)7(13-1-11-5)15-16-8-4(18(21)22)6(10)12-2-14-8;/h1-2H,(H3,9,11,13,15)(H3,10,12,14,16);1H2