3-methyl-1-[9-(oxiran-2-yl)nonyl]-7H-purine-2,6-dione

Systemtic Name: 3-methyl-1-[9-(oxiran-2-yl)nonyl]-7H-purine-2,6-dione Openeye Name: 3-methyl-1-[9-(oxiran-2-yl)nonyl]-7H-purine-2,6-dione CAS Name: 3-methyl-1-[9-(2-oxiranyl)nonyl]-7H-purine-2,6-dione IUPAC Name: 3-methyl-1-[9-(oxiran-2-yl)nonyl]-7H-purine-2,6-dione Traditional Name: 3-methyl-1-[9-(oxiran-2-yl)nonyl]-7H-purine-2,6-quinone Formula: C17H26N4O3 MolecularWeight: 334.41334

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CCCCCCCCCC3CO3)NC=N2

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CCCCCCCCCC3CO3)NC=N2

InChI

InChI=1S/C17H26N4O3/c1-20-15-14(18-12-19-15)16(22)21(17(20)23)10-8-6-4-2-3-5-7-9-13-11-24-13/h12-13H,2-11H2,1H3,(H,18,19)