3-methoxy-5-[[[9-(oxan-2-yl)purin-6-yl]amino]methyl]phenol

Systemtic Name: 3-methoxy-5-[[[9-(oxan-2-yl)purin-6-yl]amino]methyl]phenol Openeye Name: 3-methoxy-5-[[(9-tetrahydropyran-2-ylpurin-6-yl)amino]methyl]phenol CAS Name: 3-methoxy-5-[[[9-(2-oxanyl)-6-purinyl]amino]methyl]phenol IUPAC Name: 3-methoxy-5-[[[9-(oxan-2-yl)purin-6-yl]amino]methyl]phenol Traditional Name: 3-methoxy-5-[[(9-tetrahydropyran-2-ylpurin-6-yl)amino]methyl]phenol Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)O)CNC2=NC=NC3=C2N=CN3C4CCCCO4

Isomeric SMILES

COC1=CC(=CC(=C1)O)CNC2=NC=NC3=C2N=CN3C4CCCCO4

InChI

InChI=1S/C18H21N5O3/c1-25-14-7-12(6-13(24)8-14)9-19-17-16-18(21-10-20-17)23(11-22-16)15-4-2-3-5-26-15/h6-8,10-11,15,24H,2-5,9H2,1H3,(H,19,20,21)