7-(ethoxymethyl)-3-methyl-1-(5-oxidanylidenehexyl)purine-2,6-dione

Systemtic Name: 7-(ethoxymethyl)-3-methyl-1-(5-oxidanylidenehexyl)purine-2,6-dione Openeye Name: 7-(ethoxymethyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione CAS Name: 7-(ethoxymethyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione IUPAC Name: 7-(ethoxymethyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione Traditional Name: 7-(ethoxymethyl)-1-(5-ketohexyl)-3-methyl-xanthine Formula: C15H22N4O4 MolecularWeight: 322.35958

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(=O)C

Isomeric SMILES

CCOCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(=O)C

InChI

InChI=1S/C15H22N4O4/c1-4-23-10-18-9-16-13-12(18)14(21)19(15(22)17(13)3)8-6-5-7-11(2)20/h9H,4-8,10H2,1-3H3