6-(2-hydroxyethyl)-2,4-dimethyl-7-(phenoxymethyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(2-hydroxyethyl)-2,4-dimethyl-7-(phenoxymethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-hydroxyethyl)-2,4-dimethyl-7-(phenoxymethyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-hydroxyethyl)-2,4-dimethyl-7-(phenoxymethyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-hydroxyethyl)-2,4-dimethyl-7-(phenoxymethyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-hydroxyethyl)-2,4-dimethyl-7-(phenoxymethyl)purin[7,8-a]imidazole-1,3-quinone Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCO)COC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCO)COC4=CC=CC=C4

InChI

InChI=1S/C18H19N5O4/c1-20-15-14(16(25)21(2)18(20)26)23-10-12(22(8-9-24)17(23)19-15)11-27-13-6-4-3-5-7-13/h3-7,10,24H,8-9,11H2,1-2H3