7-(ethoxymethyl)-3-(6-methyl-6-oxidanyl-heptyl)purine-2,6-dione

Systemtic Name: 7-(ethoxymethyl)-3-(6-methyl-6-oxidanyl-heptyl)purine-2,6-dione Openeye Name: 7-(ethoxymethyl)-3-(6-hydroxy-6-methyl-heptyl)purine-2,6-dione CAS Name: 7-(ethoxymethyl)-3-(6-hydroxy-6-methylheptyl)purine-2,6-dione IUPAC Name: 7-(ethoxymethyl)-3-(6-hydroxy-6-methylheptyl)purine-2,6-dione Traditional Name: 7-(ethoxymethyl)-3-(6-hydroxy-6-methyl-heptyl)xanthine Formula: C16H26N4O4 MolecularWeight: 338.40204

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C=NC2=C1C(=O)NC(=O)N2CCCCCC(C)(C)O

Isomeric SMILES

CCOCN1C=NC2=C1C(=O)NC(=O)N2CCCCCC(C)(C)O

InChI

InChI=1S/C16H26N4O4/c1-4-24-11-19-10-17-13-12(19)14(21)18-15(22)20(13)9-7-5-6-8-16(2,3)23/h10,23H,4-9,11H2,1-3H3,(H,18,21,22)