8-(4-tert-butylphenoxy)-1,3-dimethyl-7-propan-2-yl-purine-2,6-dione

Systemtic Name: 8-(4-tert-butylphenoxy)-1,3-dimethyl-7-propan-2-yl-purine-2,6-dione Openeye Name: 8-(4-tert-butylphenoxy)-7-isopropyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(4-tert-butylphenoxy)-1,3-dimethyl-7-propan-2-ylpurine-2,6-dione IUPAC Name: 8-(4-tert-butylphenoxy)-1,3-dimethyl-7-propan-2-ylpurine-2,6-dione Traditional Name: 8-(4-tert-butylphenoxy)-7-isopropyl-1,3-dimethyl-xanthine Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(N=C1OC3=CC=C(C=C3)C(C)(C)C)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)N1C2=C(N=C1OC3=CC=C(C=C3)C(C)(C)C)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C20H26N4O3/c1-12(2)24-15-16(22(6)19(26)23(7)17(15)25)21-18(24)27-14-10-8-13(9-11-14)20(3,4)5/h8-12H,1-7H3