1-(6-methyldec-1-en-4-yl)-3,7-dihydropurine-2,6-dione

Systemtic Name: 1-(6-methyldec-1-en-4-yl)-3,7-dihydropurine-2,6-dione Openeye Name: 1-(1-allyl-3-methyl-heptyl)-3,7-dihydropurine-2,6-dione CAS Name: 1-(6-methyldec-1-en-4-yl)-3,7-dihydropurine-2,6-dione IUPAC Name: 1-(6-methyldec-1-en-4-yl)-3,7-dihydropurine-2,6-dione Traditional Name: 1-[1-(2-methylhexyl)but-3-enyl]-7H-xanthine Formula: C16H24N4O2 MolecularWeight: 304.38736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(CC=C)N1C(=O)C2=C(NC1=O)N=CN2

Isomeric SMILES

CCCCC(C)CC(CC=C)N1C(=O)C2=C(NC1=O)N=CN2

InChI

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