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

Systemtic Name: 3,7-dimethyl-1-[4-(2-methyl-1,3-dioxolan-2-yl)butyl]purine-2,6-dione Openeye Name: 3,7-dimethyl-1-[4-(2-methyl-1,3-dioxolan-2-yl)butyl]purine-2,6-dione CAS Name: 3,7-dimethyl-1-[4-(2-methyl-1,3-dioxolan-2-yl)butyl]purine-2,6-dione IUPAC Name: 3,7-dimethyl-1-[4-(2-methyl-1,3-dioxolan-2-yl)butyl]purine-2,6-dione Traditional Name: 3,7-dimethyl-1-[4-(2-methyl-1,3-dioxolan-2-yl)butyl]xanthine Formula: C15H22N4O4 MolecularWeight: 322.35958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)CCCCN2C(=O)C3=C(N=CN3C)N(C2=O)C

Isomeric SMILES

CC1(OCCO1)CCCCN2C(=O)C3=C(N=CN3C)N(C2=O)C

InChI

InChI=1S/C15H22N4O4/c1-15(22-8-9-23-15)6-4-5-7-19-13(20)11-12(16-10-17(11)2)18(3)14(19)21/h10H,4-9H2,1-3H3