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

Systemtic Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-ethyl-1-propyl-purine-2,6-dione Openeye Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-ethyl-1-propyl-purine-2,6-dione CAS Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-ethyl-1-propylpurine-2,6-dione IUPAC Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-ethyl-1-propylpurine-2,6-dione Traditional Name: 7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)butyl]-3-ethyl-1-propyl-xanthine Formula: C19H30N4O4 MolecularWeight: 378.4659

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=CN2CCCCC3COC(O3)(C)C)N(C1=O)CC

Isomeric SMILES

CCCN1C(=O)C2=C(N=CN2CCCCC3COC(O3)(C)C)N(C1=O)CC

InChI

InChI=1S/C19H30N4O4/c1-5-10-23-17(24)15-16(22(6-2)18(23)25)20-13-21(15)11-8-7-9-14-12-26-19(3,4)27-14/h13-14H,5-12H2,1-4H3