8-(4-cyclohexylphenoxy)-7-ethyl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-(4-cyclohexylphenoxy)-7-ethyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-(4-cyclohexylphenoxy)-7-ethyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(4-cyclohexylphenoxy)-7-ethyl-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-(4-cyclohexylphenoxy)-7-ethyl-1,3-dimethylpurine-2,6-dione Traditional Name: 8-(4-cyclohexylphenoxy)-7-ethyl-1,3-dimethyl-xanthine Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(N=C1OC3=CC=C(C=C3)C4CCCCC4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCN1C2=C(N=C1OC3=CC=C(C=C3)C4CCCCC4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C21H26N4O3/c1-4-25-17-18(23(2)21(27)24(3)19(17)26)22-20(25)28-16-12-10-15(11-13-16)14-8-6-5-7-9-14/h10-14H,4-9H2,1-3H3