3-[5-[(6-azanyl-8-propan-2-yl-purin-3-yl)methyl]-2-methoxy-phenoxy]cyclopentan-1-ol hydrochloride

Systemtic Name: 3-[5-[(6-azanyl-8-propan-2-yl-purin-3-yl)methyl]-2-methoxy-phenoxy]cyclopentan-1-ol hydrochloride Openeye Name: 3-[5-[(6-amino-8-isopropyl-purin-3-yl)methyl]-2-methoxy-phenoxy]cyclopentanol hydrochloride CAS Name: 3-[5-[(6-amino-8-propan-2-yl-3-purinyl)methyl]-2-methoxyphenoxy]-1-cyclopentanol hydrochloride IUPAC Name: 3-[5-[(6-amino-8-propan-2-ylpurin-3-yl)methyl]-2-methoxyphenoxy]cyclopentan-1-ol hydrochloride Traditional Name: 3-[5-[(6-amino-8-isopropyl-purin-3-yl)methyl]-2-methoxy-phenoxy]cyclopentanol hydrochloride Formula: C21H28ClN5O3 MolecularWeight: 433.93172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O3.ClH/c1-12(2)20-24-18-19(22)23-11-26(21(18)25-20)10-13-4-7-16(28-3)17(8-13)29-15-6-5-14(27)9-15;/h4,7-8,11-12,14-15,27H,5-6,9-10,22H2,1-3H3;1H