(1S,3R)-3-[[6-(4-methylphenyl)purin-9-yl]methyl]-2,3-dihydro-1H-inden-1-ol

Systemtic Name: (1S,3R)-3-[[6-(4-methylphenyl)purin-9-yl]methyl]-2,3-dihydro-1H-inden-1-ol Openeye Name: (1S,3R)-3-[[6-(p-tolyl)purin-9-yl]methyl]indan-1-ol CAS Name: (1S,3R)-3-[[6-(4-methylphenyl)-9-purinyl]methyl]-2,3-dihydro-1H-inden-1-ol IUPAC Name: (1S,3R)-3-[[6-(4-methylphenyl)purin-9-yl]methyl]-2,3-dihydro-1H-inden-1-ol Traditional Name: (1S,3R)-3-[[6-(p-tolyl)purin-9-yl]methyl]indan-1-ol Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C(=NC=N2)N(C=N3)CC4CC(C5=CC=CC=C45)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C(=NC=N2)N(C=N3)C[C@@H]4C[C@@H](C5=CC=CC=C45)O

InChI

InChI=1S/C22H20N4O/c1-14-6-8-15(9-7-14)20-21-22(24-12-23-20)26(13-25-21)11-16-10-19(27)18-5-3-2-4-17(16)18/h2-9,12-13,16,19,27H,10-11H2,1H3/t16-,19-/m0/s1