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1-methyl-3-pentyl-7H-purine-2,6-dione

1-methyl-3-pentyl-7H-purine-2,6-dione

Systemtic Name:1-methyl-3-pentyl-7H-purine-2,6-dione
Openeye Name:1-methyl-3-pentyl-7H-purine-2,6-dione
CAS Name:1-methyl-3-pentyl-7H-purine-2,6-dione
IUPAC Name:1-methyl-3-pentyl-7H-purine-2,6-dione
Traditional Name:3-amyl-1-methyl-7H-purine-2,6-quinone
Formula: C11H16N4O2
MolecularWeight: 236.27034
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C(=O)N(C1=O)C)NC=N2


Isomeric SMILES

CCCCCN1C2=C(C(=O)N(C1=O)C)NC=N2


InChI

InChI=1S/C11H16N4O2/c1-3-4-5-6-15-9-8(12-7-13-9)10(16)14(2)11(15)17/h7H,3-6H2,1-2H3,(H,12,13)


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