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

Systemtic Name: 1,3-dibutyl-8-chloranyl-7H-purine-2,6-dione Openeye Name: 1,3-dibutyl-8-chloro-7H-purine-2,6-dione CAS Name: 1,3-dibutyl-8-chloro-7H-purine-2,6-dione IUPAC Name: 1,3-dibutyl-8-chloro-7H-purine-2,6-dione Traditional Name: 1,3-dibutyl-8-chloro-7H-purine-2,6-quinone Formula: C13H19ClN4O2 MolecularWeight: 298.76856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CCCC)NC(=N2)Cl

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CCCC)NC(=N2)Cl

InChI

InChI=1S/C13H19ClN4O2/c1-3-5-7-17-10-9(15-12(14)16-10)11(19)18(13(17)20)8-6-4-2/h3-8H2,1-2H3,(H,15,16)