3-[2-methoxy-5-[[8-(2-oxidanylpropan-2-yl)purin-3-yl]methyl]phenoxy]cyclopentan-1-ol

Systemtic Name: 3-[2-methoxy-5-[[8-(2-oxidanylpropan-2-yl)purin-3-yl]methyl]phenoxy]cyclopentan-1-ol Openeye Name: 3-[5-[[8-(1-hydroxy-1-methyl-ethyl)purin-3-yl]methyl]-2-methoxy-phenoxy]cyclopentanol CAS Name: 3-[5-[[8-(2-hydroxypropan-2-yl)-3-purinyl]methyl]-2-methoxyphenoxy]-1-cyclopentanol IUPAC Name: 3-[5-[[8-(2-hydroxypropan-2-yl)purin-3-yl]methyl]-2-methoxyphenoxy]cyclopentan-1-ol Traditional Name: 3-[5-[[8-(1-hydroxy-1-methyl-ethyl)purin-3-yl]methyl]-2-methoxy-phenoxy]cyclopentanol Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC2=CN=CN(C2=N1)CC3=CC(=C(C=C3)OC)OC4CCC(C4)O)O

Isomeric SMILES

CC(C)(C1=NC2=CN=CN(C2=N1)CC3=CC(=C(C=C3)OC)OC4CCC(C4)O)O

InChI

InChI=1S/C21H26N4O4/c1-21(2,27)20-23-16-10-22-12-25(19(16)24-20)11-13-4-7-17(28-3)18(8-13)29-15-6-5-14(26)9-15/h4,7-8,10,12,14-15,26-27H,5-6,9,11H2,1-3H3