8-chloranyl-7-[2-(4-ethoxyphenoxy)ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-chloranyl-7-[2-(4-ethoxyphenoxy)ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-[2-(4-ethoxyphenoxy)ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-[2-(4-ethoxyphenoxy)ethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-[2-(4-ethoxyphenoxy)ethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-[2-(4-ethoxyphenoxy)ethyl]-1,3-dimethyl-xanthine Formula: C17H19ClN4O4 MolecularWeight: 378.81016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCN2C3=C(N=C2Cl)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCN2C3=C(N=C2Cl)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C17H19ClN4O4/c1-4-25-11-5-7-12(8-6-11)26-10-9-22-13-14(19-16(22)18)20(2)17(24)21(3)15(13)23/h5-8H,4,9-10H2,1-3H3