3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)-7H-purin-6-one

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)-7H-purin-6-one Openeye Name: 8-(1-benzyloxy-1-methyl-ethyl)-3-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-7H-purin-6-one CAS Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)-7H-purin-6-one IUPAC Name: 3-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)-7H-purin-6-one Traditional Name: 8-(1-benzoxy-1-methyl-ethyl)-3-[3-(cyclopentoxy)-4-methoxy-benzyl]-7H-purin-6-one Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC2=C(N1)C(=O)N=CN2CC3=CC(=C(C=C3)OC)OC4CCCC4)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C1=NC2=C(N1)C(=O)N=CN2CC3=CC(=C(C=C3)OC)OC4CCCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H32N4O4/c1-28(2,35-17-19-9-5-4-6-10-19)27-30-24-25(31-27)32(18-29-26(24)33)16-20-13-14-22(34-3)23(15-20)36-21-11-7-8-12-21/h4-6,9-10,13-15,18,21H,7-8,11-12,16-17H2,1-3H3,(H,30,31)