8-chloranyl-3-(4-methylpentyl)-7H-purine-2,6-dione

Systemtic Name: 8-chloranyl-3-(4-methylpentyl)-7H-purine-2,6-dione Openeye Name: 8-chloro-3-isohexyl-7H-purine-2,6-dione CAS Name: 8-chloro-3-(4-methylpentyl)-7H-purine-2,6-dione IUPAC Name: 8-chloro-3-(4-methylpentyl)-7H-purine-2,6-dione Traditional Name: 8-chloro-3-isohexyl-7H-purine-2,6-quinone Formula: C11H15ClN4O2 MolecularWeight: 270.7154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1C2=C(C(=O)NC1=O)NC(=N2)Cl

Isomeric SMILES

CC(C)CCCN1C2=C(C(=O)NC1=O)NC(=N2)Cl

InChI

InChI=1S/C11H15ClN4O2/c1-6(2)4-3-5-16-8-7(13-10(12)14-8)9(17)15-11(16)18/h6H,3-5H2,1-2H3,(H,13,14)(H,15,17,18)