3-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-7-methyl-6-phenyl-5H-imidazo[1,2-a]purin-9-one

Systemtic Name: 3-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-7-methyl-6-phenyl-5H-imidazo[1,2-a]purin-9-one Openeye Name: 3-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-7-methyl-6-phenyl-5H-imidazo[1,2-a]purin-9-one CAS Name: 3-(1,3-dihydroxypropan-2-yloxymethyl)-7-methyl-6-phenyl-5H-imidazo[1,2-a]purin-9-one IUPAC Name: 3-(1,3-dihydroxypropan-2-yloxymethyl)-7-methyl-6-phenyl-5H-imidazo[1,2-a]purin-9-one Traditional Name: 3-[(2-hydroxy-1-methylol-ethoxy)methyl]-7-methyl-6-phenyl-5H-imidazo[1,2-a]purin-9-one Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=NC3=C(C(=O)N12)N=CN3COC(CO)CO)C4=CC=CC=C4

Isomeric SMILES

CC1=C(NC2=NC3=C(C(=O)N12)N=CN3COC(CO)CO)C4=CC=CC=C4

InChI

InChI=1S/C18H19N5O4/c1-11-14(12-5-3-2-4-6-12)20-18-21-16-15(17(26)23(11)18)19-9-22(16)10-27-13(7-24)8-25/h2-6,9,13,24-25H,7-8,10H2,1H3,(H,20,21)