7-ethyl-1-hex-5-enyl-3-methyl-purine-2,6-dione

Systemtic Name: 7-ethyl-1-hex-5-enyl-3-methyl-purine-2,6-dione Openeye Name: 7-ethyl-1-hex-5-enyl-3-methyl-purine-2,6-dione CAS Name: 7-ethyl-1-hex-5-enyl-3-methylpurine-2,6-dione IUPAC Name: 7-ethyl-1-hex-5-enyl-3-methylpurine-2,6-dione Traditional Name: 7-ethyl-1-hex-5-enyl-3-methyl-xanthine Formula: C14H20N4O2 MolecularWeight: 276.3342

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC=C

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC=C

InChI

InChI=1S/C14H20N4O2/c1-4-6-7-8-9-18-13(19)11-12(16(3)14(18)20)15-10-17(11)5-2/h4,10H,1,5-9H2,2-3H3