7-ethyl-1,3-dimethyl-8-(2-propan-2-ylphenoxy)purine-2,6-dione

Systemtic Name: 7-ethyl-1,3-dimethyl-8-(2-propan-2-ylphenoxy)purine-2,6-dione Openeye Name: 7-ethyl-8-(2-isopropylphenoxy)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-ethyl-1,3-dimethyl-8-(2-propan-2-ylphenoxy)purine-2,6-dione IUPAC Name: 7-ethyl-1,3-dimethyl-8-(2-propan-2-ylphenoxy)purine-2,6-dione Traditional Name: 7-ethyl-8-(2-isopropylphenoxy)-1,3-dimethyl-xanthine Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O3/c1-6-22-14-15(20(4)18(24)21(5)16(14)23)19-17(22)25-13-10-8-7-9-12(13)11(2)3/h7-11H,6H2,1-5H3