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

Systemtic Name: 8-ethyl-1-(3-oxidanylpropyl)-3-propyl-7H-purine-2,6-dione Openeye Name: 8-ethyl-1-(3-hydroxypropyl)-3-propyl-7H-purine-2,6-dione CAS Name: 8-ethyl-1-(3-hydroxypropyl)-3-propyl-7H-purine-2,6-dione IUPAC Name: 8-ethyl-1-(3-hydroxypropyl)-3-propyl-7H-purine-2,6-dione Traditional Name: 8-ethyl-1-(3-hydroxypropyl)-3-propyl-7H-purine-2,6-quinone Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4O3/c1-3-6-16-11-10(14-9(4-2)15-11)12(19)17(13(16)20)7-5-8-18/h18H,3-8H2,1-2H3,(H,14,15)