7-ethyl-1,3-dimethyl-8-(2-pyrrolidin-1-ylcarbonylphenoxy)purine-2,6-dione

Systemtic Name: 7-ethyl-1,3-dimethyl-8-(2-pyrrolidin-1-ylcarbonylphenoxy)purine-2,6-dione Openeye Name: 7-ethyl-1,3-dimethyl-8-[2-(pyrrolidine-1-carbonyl)phenoxy]purine-2,6-dione CAS Name: 7-ethyl-1,3-dimethyl-8-[2-[oxo(1-pyrrolidinyl)methyl]phenoxy]purine-2,6-dione IUPAC Name: 7-ethyl-1,3-dimethyl-8-[2-(pyrrolidine-1-carbonyl)phenoxy]purine-2,6-dione Traditional Name: 7-ethyl-1,3-dimethyl-8-[2-(pyrrolidine-1-carbonyl)phenoxy]xanthine Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1OC3=CC=CC=C3C(=O)N4CCCC4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1OC3=CC=CC=C3C(=O)N4CCCC4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C20H23N5O4/c1-4-25-15-16(22(2)20(28)23(3)18(15)27)21-19(25)29-14-10-6-5-9-13(14)17(26)24-11-7-8-12-24/h5-6,9-10H,4,7-8,11-12H2,1-3H3