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

Systemtic Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-propyl-purine-2,6-dione Openeye Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-propyl-purine-2,6-dione CAS Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-propylpurine-2,6-dione IUPAC Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-propylpurine-2,6-dione Traditional Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-propyl-xanthine Formula: C17H26N4O4 MolecularWeight: 350.41274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)NC1=O)N(C=N2)CCCCC3COC(O3)(C)C

Isomeric SMILES

CCCN1C2=C(C(=O)NC1=O)N(C=N2)CCCCC3COC(O3)(C)C

InChI

InChI=1S/C17H26N4O4/c1-4-8-21-14-13(15(22)19-16(21)23)20(11-18-14)9-6-5-7-12-10-24-17(2,3)25-12/h11-12H,4-10H2,1-3H3,(H,19,22,23)