7-(2,2-dimethylbutanoyl)-1-hex-5-enyl-3-methyl-purine-2,6-dione

Systemtic Name: 7-(2,2-dimethylbutanoyl)-1-hex-5-enyl-3-methyl-purine-2,6-dione Openeye Name: 7-(2,2-dimethylbutanoyl)-1-hex-5-enyl-3-methyl-purine-2,6-dione CAS Name: 7-(2,2-dimethyl-1-oxobutyl)-1-hex-5-enyl-3-methylpurine-2,6-dione IUPAC Name: 7-(2,2-dimethylbutanoyl)-1-hex-5-enyl-3-methylpurine-2,6-dione Traditional Name: 7-(2,2-dimethylbutanoyl)-1-hex-5-enyl-3-methyl-xanthine Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)N1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC=C

Isomeric SMILES

CCC(C)(C)C(=O)N1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC=C

InChI

InChI=1S/C18H26N4O3/c1-6-8-9-10-11-21-15(23)13-14(20(5)17(21)25)19-12-22(13)16(24)18(3,4)7-2/h6,12H,1,7-11H2,2-5H3