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

Systemtic Name: 3-butyl-7-(2-methyl-1,3-dioxolan-2-yl)purine-2,6-dione Openeye Name: 3-butyl-7-(2-methyl-1,3-dioxolan-2-yl)purine-2,6-dione CAS Name: 3-butyl-7-(2-methyl-1,3-dioxolan-2-yl)purine-2,6-dione IUPAC Name: 3-butyl-7-(2-methyl-1,3-dioxolan-2-yl)purine-2,6-dione Traditional Name: 3-butyl-7-(2-methyl-1,3-dioxolan-2-yl)xanthine Formula: C13H18N4O4 MolecularWeight: 294.30642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C=N2)C3(OCCO3)C

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C=N2)C3(OCCO3)C

InChI

InChI=1S/C13H18N4O4/c1-3-4-5-16-10-9(11(18)15-12(16)19)17(8-14-10)13(2)20-6-7-21-13/h8H,3-7H2,1-2H3,(H,15,18,19)