3-methyl-1-(5-oxidanylpentyl)-7H-purine-2,6-dione

Systemtic Name: 3-methyl-1-(5-oxidanylpentyl)-7H-purine-2,6-dione Openeye Name: 1-(5-hydroxypentyl)-3-methyl-7H-purine-2,6-dione CAS Name: 1-(5-hydroxypentyl)-3-methyl-7H-purine-2,6-dione IUPAC Name: 1-(5-hydroxypentyl)-3-methyl-7H-purine-2,6-dione Traditional Name: 1-(5-hydroxypentyl)-3-methyl-7H-purine-2,6-quinone Formula: C11H16N4O3 MolecularWeight: 252.26974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CCCCCO)NC=N2

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CCCCCO)NC=N2

InChI

InChI=1S/C11H16N4O3/c1-14-9-8(12-7-13-9)10(17)15(11(14)18)5-3-2-4-6-16/h7,16H,2-6H2,1H3,(H,12,13)