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

Systemtic Name: 7-hex-5-enyl-3-methyl-1-(2-methylpropyl)purine-2,6-dione Openeye Name: 7-hex-5-enyl-1-isobutyl-3-methyl-purine-2,6-dione CAS Name: 7-hex-5-enyl-3-methyl-1-(2-methylpropyl)purine-2,6-dione IUPAC Name: 7-hex-5-enyl-3-methyl-1-(2-methylpropyl)purine-2,6-dione Traditional Name: 7-hex-5-enyl-1-isobutyl-3-methyl-xanthine Formula: C16H24N4O2 MolecularWeight: 304.38736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(N=CN2CCCCC=C)N(C1=O)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(N=CN2CCCCC=C)N(C1=O)C

InChI

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