8-methyl-1-(3-oxidanylpropyl)-3-propyl-7H-purine-2,6-dione

Systemtic Name: 8-methyl-1-(3-oxidanylpropyl)-3-propyl-7H-purine-2,6-dione Openeye Name: 1-(3-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-dione CAS Name: 1-(3-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-dione IUPAC Name: 1-(3-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-dione Traditional Name: 1-(3-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-quinone Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCCO)NC(=N2)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCCO)NC(=N2)C

InChI

InChI=1S/C12H18N4O3/c1-3-5-15-10-9(13-8(2)14-10)11(18)16(12(15)19)6-4-7-17/h17H,3-7H2,1-2H3,(H,13,14)