4-methyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-7-phenyl-purino[8,7-b][1,3]oxazole-1,3-dione

Systemtic Name: 4-methyl-2-[(2R)-3-oxidanylidenebutan-2-yl]-7-phenyl-purino[8,7-b][1,3]oxazole-1,3-dione Openeye Name: 4-methyl-2-[(1R)-1-methyl-2-oxo-propyl]-7-phenyl-purino[8,7-b]oxazole-1,3-dione CAS Name: 4-methyl-2-[(2R)-3-oxobutan-2-yl]-7-phenylpurino[8,7-b]oxazole-1,3-dione IUPAC Name: 4-methyl-2-[(2R)-3-oxobutan-2-yl]-7-phenylpurino[8,7-b][1,3]oxazole-1,3-dione Traditional Name: 2-[(1R)-2-keto-1-methyl-propyl]-4-methyl-7-phenyl-purino[8,7-b]oxazole-1,3-quinone Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)N1C(=O)C2=C(N=C3N2C=C(O3)C4=CC=CC=C4)N(C1=O)C

Isomeric SMILES

C[C@H](C(=O)C)N1C(=O)C2=C(N=C3N2C=C(O3)C4=CC=CC=C4)N(C1=O)C

InChI

InChI=1S/C18H16N4O4/c1-10(11(2)23)22-16(24)14-15(20(3)18(22)25)19-17-21(14)9-13(26-17)12-7-5-4-6-8-12/h4-10H,1-3H3/t10-/m1/s1