3-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-6-(4-phenylphenyl)-5H-imidazo[1,2-a]purin-9-one

Systemtic Name: 3-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-6-(4-phenylphenyl)-5H-imidazo[1,2-a]purin-9-one Openeye Name: 3-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-6-(4-phenylphenyl)-5H-imidazo[1,2-a]purin-9-one CAS Name: 3-(1,3-dihydroxypropan-2-yloxymethyl)-6-(4-phenylphenyl)-5H-imidazo[1,2-a]purin-9-one IUPAC Name: 3-(1,3-dihydroxypropan-2-yloxymethyl)-6-(4-phenylphenyl)-5H-imidazo[1,2-a]purin-9-one Traditional Name: 3-[(2-hydroxy-1-methylol-ethoxy)methyl]-6-(4-phenylphenyl)-5H-imidazo[1,2-a]purin-9-one Formula: C23H21N5O4 MolecularWeight: 431.44394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN4C(=O)C5=C(N=C4N3)N(C=N5)COC(CO)CO

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN4C(=O)C5=C(N=C4N3)N(C=N5)COC(CO)CO

InChI

InChI=1S/C23H21N5O4/c29-11-18(12-30)32-14-27-13-24-20-21(27)26-23-25-19(10-28(23)22(20)31)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-10,13,18,29-30H,11-12,14H2,(H,25,26)