7-(1,3-dioxolan-2-ylmethyl)-3-methyl-purine-2,6-dione

Systemtic Name: 7-(1,3-dioxolan-2-ylmethyl)-3-methyl-purine-2,6-dione Openeye Name: 7-(1,3-dioxolan-2-ylmethyl)-3-methyl-purine-2,6-dione CAS Name: 7-(1,3-dioxolan-2-ylmethyl)-3-methylpurine-2,6-dione IUPAC Name: 7-(1,3-dioxolan-2-ylmethyl)-3-methylpurine-2,6-dione Traditional Name: 7-(1,3-dioxolan-2-ylmethyl)-3-methyl-xanthine Formula: C10H12N4O4 MolecularWeight: 252.22668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3OCCO3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3OCCO3

InChI

InChI=1S/C10H12N4O4/c1-13-8-7(9(15)12-10(13)16)14(5-11-8)4-6-17-2-3-18-6/h5-6H,2-4H2,1H3,(H,12,15,16)