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

Systemtic Name: 7-(butoxymethyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione Openeye Name: 7-(butoxymethyl)-3-isobutyl-1-methyl-purine-2,6-dione CAS Name: 7-(butoxymethyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione IUPAC Name: 7-(butoxymethyl)-1-methyl-3-(2-methylpropyl)purine-2,6-dione Traditional Name: 7-(butoxymethyl)-3-isobutyl-1-methyl-xanthine Formula: C15H24N4O3 MolecularWeight: 308.37606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCN1C=NC2=C1C(=O)N(C(=O)N2CC(C)C)C

Isomeric SMILES

CCCCOCN1C=NC2=C1C(=O)N(C(=O)N2CC(C)C)C

InChI

InChI=1S/C15H24N4O3/c1-5-6-7-22-10-18-9-16-13-12(18)14(20)17(4)15(21)19(13)8-11(2)3/h9,11H,5-8,10H2,1-4H3