6-(2-chloranyl-4-methoxy-phenyl)-8-ethyl-9-hexyl-purine

Systemtic Name: 6-(2-chloranyl-4-methoxy-phenyl)-8-ethyl-9-hexyl-purine Openeye Name: 6-(2-chloro-4-methoxy-phenyl)-8-ethyl-9-hexyl-purine CAS Name: 6-(2-chloro-4-methoxyphenyl)-8-ethyl-9-hexylpurine IUPAC Name: 6-(2-chloro-4-methoxyphenyl)-8-ethyl-9-hexylpurine Traditional Name: 6-(2-chloro-4-methoxy-phenyl)-8-ethyl-9-hexyl-purine Formula: C20H25ClN4O MolecularWeight: 372.8917

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=NC2=C(N=CN=C21)C3=C(C=C(C=C3)OC)Cl)CC

Isomeric SMILES

CCCCCCN1C(=NC2=C(N=CN=C21)C3=C(C=C(C=C3)OC)Cl)CC

InChI

InChI=1S/C20H25ClN4O/c1-4-6-7-8-11-25-17(5-2)24-19-18(22-13-23-20(19)25)15-10-9-14(26-3)12-16(15)21/h9-10,12-13H,4-8,11H2,1-3H3