3-ethyl-7-methyl-1-(6-methylhept-5-enyl)purine-2,6-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CCCCC=C(C)C)N(C=N2)C

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CCCCC=C(C)C)N(C=N2)C

InChI

InChI=1S/C16H24N4O2/c1-5-19-14-13(18(4)11-17-14)15(21)20(16(19)22)10-8-6-7-9-12(2)3/h9,11H,5-8,10H2,1-4H3