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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC=C

Isomeric SMILES

CC(C)CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC=C

InChI

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