[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl nitrite

Systemtic Name: [8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl nitrite Openeye Name: (8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)methyl nitrite CAS Name: nitrous acid (8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)methyl ester IUPAC Name: (8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)methyl nitrite Traditional Name: nitrous acid (8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)methyl ester Formula: C8H8ClN5O4 MolecularWeight: 273.63322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CON=O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CON=O

InChI

InChI=1S/C8H8ClN5O4/c1-12-5-4(6(15)13(2)8(12)16)14(3-18-11-17)7(9)10-5/h3H2,1-2H3