2-methyl-5-(4-methyl-2-nitro-phenyl)-1,2-oxazol-3-one

Systemtic Name: 2-methyl-5-(4-methyl-2-nitro-phenyl)-1,2-oxazol-3-one Openeye Name: 2-methyl-5-(4-methyl-2-nitro-phenyl)isoxazol-3-one CAS Name: 2-methyl-5-(4-methyl-2-nitrophenyl)-3-isoxazolone IUPAC Name: 2-methyl-5-(4-methyl-2-nitrophenyl)-1,2-oxazol-3-one Traditional Name: 2-methyl-5-(4-methyl-2-nitro-phenyl)-4-isoxazolin-3-one Formula: C11H10N2O4 MolecularWeight: 234.2081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC(=O)N(O2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC(=O)N(O2)C)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O4/c1-7-3-4-8(9(5-7)13(15)16)10-6-11(14)12(2)17-10/h3-6H,1-2H3