3-methyl-1-(6-oxidanylideneheptyl)-7-(4-oxidanylidenepentyl)purine-2,6-dione

Systemtic Name: 3-methyl-1-(6-oxidanylideneheptyl)-7-(4-oxidanylidenepentyl)purine-2,6-dione Openeye Name: 3-methyl-1-(6-oxoheptyl)-7-(4-oxopentyl)purine-2,6-dione CAS Name: 3-methyl-1-(6-oxoheptyl)-7-(4-oxopentyl)purine-2,6-dione IUPAC Name: 3-methyl-1-(6-oxoheptyl)-7-(4-oxopentyl)purine-2,6-dione Traditional Name: 1-(6-ketoheptyl)-7-(4-ketopentyl)-3-methyl-xanthine Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCN1C(=O)C2=C(N=CN2CCCC(=O)C)N(C1=O)C

Isomeric SMILES

CC(=O)CCCCCN1C(=O)C2=C(N=CN2CCCC(=O)C)N(C1=O)C

InChI

InChI=1S/C18H26N4O4/c1-13(23)8-5-4-6-11-22-17(25)15-16(20(3)18(22)26)19-12-21(15)10-7-9-14(2)24/h12H,4-11H2,1-3H3