(4E)-2-methyl-4-[(3-nitro-2-oxidanyl-phenyl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4E)-2-methyl-4-[(3-nitro-2-oxidanyl-phenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-4-[(2-hydroxy-3-nitro-phenyl)methylene]-2-methyl-oxazol-5-one CAS Name: (4E)-4-[(2-hydroxy-3-nitrophenyl)methylidene]-2-methyl-5-oxazolone IUPAC Name: (4E)-4-[(2-hydroxy-3-nitrophenyl)methylidene]-2-methyl-1,3-oxazol-5-one Traditional Name: (4E)-4-(2-hydroxy-3-nitro-benzylidene)-2-methyl-2-oxazolin-5-one Formula: C11H8N2O5 MolecularWeight: 248.19162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=C(C(=CC=C2)[N+](=O)[O-])O)C(=O)O1

Isomeric SMILES

CC1=N/C(=C/C2=C(C(=CC=C2)[N+](=O)[O-])O)/C(=O)O1

InChI

InChI=1S/C11H8N2O5/c1-6-12-8(11(15)18-6)5-7-3-2-4-9(10(7)14)13(16)17/h2-5,14H,1H3/b8-5+