7-butyl-3-propyl-purine-2,6-dione

Systemtic Name: 7-butyl-3-propyl-purine-2,6-dione Openeye Name: 7-butyl-3-propyl-purine-2,6-dione CAS Name: 7-butyl-3-propylpurine-2,6-dione IUPAC Name: 7-butyl-3-propylpurine-2,6-dione Traditional Name: 7-butyl-3-propyl-xanthine Formula: C12H18N4O2 MolecularWeight: 250.29692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1C(=O)NC(=O)N2CCC

Isomeric SMILES

CCCCN1C=NC2=C1C(=O)NC(=O)N2CCC

InChI

InChI=1S/C12H18N4O2/c1-3-5-7-15-8-13-10-9(15)11(17)14-12(18)16(10)6-4-2/h8H,3-7H2,1-2H3,(H,14,17,18)