4-methyl-7-(3-nitrophenyl)purino[8,7-b][1,3]oxazole-1,3-dione

Systemtic Name: 4-methyl-7-(3-nitrophenyl)purino[8,7-b][1,3]oxazole-1,3-dione Openeye Name: 4-methyl-7-(3-nitrophenyl)purino[8,7-b]oxazole-1,3-dione CAS Name: 4-methyl-7-(3-nitrophenyl)purino[8,7-b]oxazole-1,3-dione IUPAC Name: 4-methyl-7-(3-nitrophenyl)purino[8,7-b][1,3]oxazole-1,3-dione Traditional Name: 4-methyl-7-(3-nitrophenyl)purino[8,7-b]oxazole-1,3-quinone Formula: C14H9N5O5 MolecularWeight: 327.25176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3C=C(OC3=N2)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3C=C(OC3=N2)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O5/c1-17-11-10(12(20)16-13(17)21)18-6-9(24-14(18)15-11)7-3-2-4-8(5-7)19(22)23/h2-6H,1H3,(H,16,20,21)