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8-chloranyl-1,7-dimethyl-3H-purine-2,6-dione

8-chloranyl-1,7-dimethyl-3H-purine-2,6-dione

Systemtic Name:8-chloranyl-1,7-dimethyl-3H-purine-2,6-dione
Openeye Name:8-chloro-1,7-dimethyl-3H-purine-2,6-dione
CAS Name:8-chloro-1,7-dimethyl-3H-purine-2,6-dione
IUPAC Name:8-chloro-1,7-dimethyl-3H-purine-2,6-dione
Traditional Name:8-chloro-1,7-dimethyl-xanthine
Formula: C7H7ClN4O2
MolecularWeight: 214.60908
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(NC(=O)N(C2=O)C)N=C1Cl


Isomeric SMILES

CN1C2=C(NC(=O)N(C2=O)C)N=C1Cl


InChI

InChI=1S/C7H7ClN4O2/c1-11-3-4(9-6(11)8)10-7(14)12(2)5(3)13/h1-2H3,(H,10,14)


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