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

Systemtic Name: 2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl phosphate Openeye Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl phosphate CAS Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl phosphate IUPAC Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl phosphate Traditional Name: 2-(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)ethyl phosphate Formula: C9H10ClN4O6P-2 MolecularWeight: 336.625661

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CCOP(=O)([O-])[O-]

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CCOP(=O)([O-])[O-]

InChI

InChI=1S/C9H12ClN4O6P/c1-12-6-5(7(15)13(2)9(12)16)14(8(10)11-6)3-4-20-21(17,18)19/h3-4H2,1-2H3,(H2,17,18,19)/p-2