3,7,9-tris(chloranyl)-1-isocyano-purine-2,6,8-trione

Systemtic Name: 3,7,9-tris(chloranyl)-1-isocyano-purine-2,6,8-trione Openeye Name: 3,7,9-trichloro-1-isocyano-purine-2,6,8-trione CAS Name: 3,7,9-trichloro-1-isocyanopurine-2,6,8-trione IUPAC Name: 3,7,9-trichloro-1-isocyanopurine-2,6,8-trione Traditional Name: 3,7,9-trichloro-1-isocyano-uric acid Formula: C6Cl3N5O3 MolecularWeight: 296.4549

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]N1C(=O)C2=C(N(C(=O)N2Cl)Cl)N(C1=O)Cl

Isomeric SMILES

[C-]#[N+]N1C(=O)C2=C(N(C(=O)N2Cl)Cl)N(C1=O)Cl

InChI

InChI=1S/C6Cl3N5O3/c1-10-14-4(15)2-3(13(9)6(14)17)12(8)5(16)11(2)7