7-(3,3-diethoxypropyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione

Systemtic Name: 7-(3,3-diethoxypropyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione Openeye Name: 7-(3,3-diethoxypropyl)-3-isobutyl-1-methyl-purine-2,6-dione CAS Name: 7-(3,3-diethoxypropyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione IUPAC Name: 7-(3,3-diethoxypropyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione Traditional Name: 7-(3,3-diethoxypropyl)-3-isobutyl-1-methyl-xanthine Formula: C17H28N4O4 MolecularWeight: 352.42862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCN1C=NC2=C1C(=O)N(C(=O)N2CC(C)C)C)OCC

Isomeric SMILES

CCOC(CCN1C=NC2=C1C(=O)N(C(=O)N2CC(C)C)C)OCC

InChI

InChI=1S/C17H28N4O4/c1-6-24-13(25-7-2)8-9-20-11-18-15-14(20)16(22)19(5)17(23)21(15)10-12(3)4/h11-13H,6-10H2,1-5H3