2-(5-methyl-1,2-oxazol-3-yl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(5-methyl-1,2-oxazol-3-yl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(5-methylisoxazol-3-yl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(5-methyl-3-isoxazolyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(5-methyl-1,2-oxazol-3-yl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(5-methylisoxazol-3-yl)-5-nitro-isoindoline-1,3-quinone Formula: C12H7N3O5 MolecularWeight: 273.20108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H7N3O5/c1-6-4-10(13-20-6)14-11(16)8-3-2-7(15(18)19)5-9(8)12(14)17/h2-5H,1H3