2-[[4,6-bis(oxidanylidene)-1H-1,3,5-triazin-2-yl]oxy]ethanenitrile dihydrate

Systemtic Name: 2-[[4,6-bis(oxidanylidene)-1H-1,3,5-triazin-2-yl]oxy]ethanenitrile dihydrate Openeye Name: 2-[(4,6-dioxo-1H-1,3,5-triazin-2-yl)oxy]acetonitrile dihydrate CAS Name: 2-[(4,6-dioxo-1H-1,3,5-triazin-2-yl)oxy]acetonitrile dihydrate IUPAC Name: 2-[(4,6-dioxo-1H-1,3,5-triazin-2-yl)oxy]acetonitrile dihydrate Traditional Name: 2-[(4,6-diketo-1H-s-triazin-2-yl)oxy]acetonitrile dihydrate Formula: C5H8N4O5 MolecularWeight: 204.14082

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)OC1=NC(=O)NC(=O)N1.O.O

Isomeric SMILES

C(C#N)OC1=NC(=O)NC(=O)N1.O.O

InChI

InChI=1S/C5H4N4O3.2H2O/c6-1-2-12-5-8-3(10)7-4(11)9-5;;/h2H2,(H2,7,8,9,10,11);2*1H2