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

Systemtic Name: 8-chloranyl-1-methyl-3-propyl-7H-purine-2,6-dione Openeye Name: 8-chloro-1-methyl-3-propyl-7H-purine-2,6-dione CAS Name: 8-chloro-1-methyl-3-propyl-7H-purine-2,6-dione IUPAC Name: 8-chloro-1-methyl-3-propyl-7H-purine-2,6-dione Traditional Name: 8-chloro-1-methyl-3-propyl-7H-purine-2,6-quinone Formula: C9H11ClN4O2 MolecularWeight: 242.66224

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl

InChI

InChI=1S/C9H11ClN4O2/c1-3-4-14-6-5(11-8(10)12-6)7(15)13(2)9(14)16/h3-4H2,1-2H3,(H,11,12)