7-(7-ethanoyl-8-oxidanylidene-nonyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(7-ethanoyl-8-oxidanylidene-nonyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(7-acetyl-8-oxo-nonyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(7-acetyl-8-oxononyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(7-acetyl-8-oxononyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(7-acetyl-8-keto-nonyl)-1,3-dimethyl-xanthine Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)C(=O)C

Isomeric SMILES

CC(=O)C(CCCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)C(=O)C

InChI

InChI=1S/C18H26N4O4/c1-12(23)14(13(2)24)9-7-5-6-8-10-22-11-19-16-15(22)17(25)21(4)18(26)20(16)3/h11,14H,5-10H2,1-4H3