4-methyl-6-(4-oxidanylbutyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-6-(4-oxidanylbutyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-hydroxybutyl)-4-methyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-hydroxybutyl)-4-methyl-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-hydroxybutyl)-4-methyl-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-hydroxybutyl)-4-methyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3C=C(N(C3=N2)CCCCO)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3C=C(N(C3=N2)CCCCO)C4=CC=CC=C4

InChI

InChI=1S/C18H19N5O3/c1-21-15-14(16(25)20-18(21)26)23-11-13(12-7-3-2-4-8-12)22(17(23)19-15)9-5-6-10-24/h2-4,7-8,11,24H,5-6,9-10H2,1H3,(H,20,25,26)