3-methyl-2-(4-nitrophenyl)carbonyl-1,2-oxazol-5-one

Systemtic Name: 3-methyl-2-(4-nitrophenyl)carbonyl-1,2-oxazol-5-one Openeye Name: 3-methyl-2-(4-nitrobenzoyl)isoxazol-5-one CAS Name: 3-methyl-2-[(4-nitrophenyl)-oxomethyl]-5-isoxazolone IUPAC Name: 3-methyl-2-(4-nitrobenzoyl)-1,2-oxazol-5-one Traditional Name: 3-methyl-2-(4-nitrobenzoyl)-3-isoxazolin-5-one Formula: C11H8N2O5 MolecularWeight: 248.19162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)ON1C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)ON1C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H8N2O5/c1-7-6-10(14)18-12(7)11(15)8-2-4-9(5-3-8)13(16)17/h2-6H,1H3