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

Systemtic Name: 3-methyl-1-(3-oxidanylbutyl)-7H-purine-2,6-dione Openeye Name: 1-(3-hydroxybutyl)-3-methyl-7H-purine-2,6-dione CAS Name: 1-(3-hydroxybutyl)-3-methyl-7H-purine-2,6-dione IUPAC Name: 1-(3-hydroxybutyl)-3-methyl-7H-purine-2,6-dione Traditional Name: 1-(3-hydroxybutyl)-3-methyl-7H-purine-2,6-quinone Formula: C10H14N4O3 MolecularWeight: 238.24316

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C(=O)C2=C(N=CN2)N(C1=O)C)O

Isomeric SMILES

CC(CCN1C(=O)C2=C(N=CN2)N(C1=O)C)O

InChI

InChI=1S/C10H14N4O3/c1-6(15)3-4-14-9(16)7-8(12-5-11-7)13(2)10(14)17/h5-6,15H,3-4H2,1-2H3,(H,11,12)