3-[(2-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-propyl-2,7-dihydro-1H-purin-6-one

Systemtic Name: 3-[(2-cyclopentyloxy-4-methoxy-phenyl)methyl]-8-propyl-2,7-dihydro-1H-purin-6-one Openeye Name: 3-[[2-(cyclopentoxy)-4-methoxy-phenyl]methyl]-8-propyl-2,7-dihydro-1H-purin-6-one CAS Name: 3-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-8-propyl-2,7-dihydro-1H-purin-6-one IUPAC Name: 3-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-8-propyl-2,7-dihydro-1H-purin-6-one Traditional Name: 3-[2-(cyclopentoxy)-4-methoxy-benzyl]-8-propyl-2,7-dihydro-1H-purin-6-one Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1)C(=O)NCN2CC3=C(C=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

CCCC1=NC2=C(N1)C(=O)NCN2CC3=C(C=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C21H28N4O3/c1-3-6-18-23-19-20(24-18)25(13-22-21(19)26)12-14-9-10-16(27-2)11-17(14)28-15-7-4-5-8-15/h9-11,15H,3-8,12-13H2,1-2H3,(H,22,26)(H,23,24)