1-[8-(1,3-dioxolan-4-yl)octyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-[8-(1,3-dioxolan-4-yl)octyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-[8-(1,3-dioxolan-4-yl)octyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 1-[8-(1,3-dioxolan-4-yl)octyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-[8-(1,3-dioxolan-4-yl)octyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 1-[8-(1,3-dioxolan-4-yl)octyl]-3,7-dimethyl-xanthine Formula: C18H28N4O4 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCC3COCO3

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCC3COCO3

InChI

InChI=1S/C18H28N4O4/c1-20-12-19-16-15(20)17(23)22(18(24)21(16)2)10-8-6-4-3-5-7-9-14-11-25-13-26-14/h12,14H,3-11,13H2,1-2H3