1-but-3-enyl-7-hexyl-3-methyl-purine-2,6-dione

Systemtic Name: 1-but-3-enyl-7-hexyl-3-methyl-purine-2,6-dione Openeye Name: 1-but-3-enyl-7-hexyl-3-methyl-purine-2,6-dione CAS Name: 1-but-3-enyl-7-hexyl-3-methylpurine-2,6-dione IUPAC Name: 1-but-3-enyl-7-hexyl-3-methylpurine-2,6-dione Traditional Name: 1-but-3-enyl-7-hexyl-3-methyl-xanthine Formula: C16H24N4O2 MolecularWeight: 304.38736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCC=C

Isomeric SMILES

CCCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCC=C

InChI

InChI=1S/C16H24N4O2/c1-4-6-8-9-10-19-12-17-14-13(19)15(21)20(11-7-5-2)16(22)18(14)3/h5,12H,2,4,6-11H2,1,3H3