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

Systemtic Name: (4E)-2-(2-methyl-3-nitro-phenyl)-4-[(2-nitrophenyl)methylidene]-1,3-oxazol-5-one Openeye Name: (4E)-2-(2-methyl-3-nitro-phenyl)-4-[(2-nitrophenyl)methylene]oxazol-5-one CAS Name: (4E)-2-(2-methyl-3-nitrophenyl)-4-[(2-nitrophenyl)methylidene]-5-oxazolone IUPAC Name: (4E)-2-(2-methyl-3-nitrophenyl)-4-[(2-nitrophenyl)methylidene]-1,3-oxazol-5-one Traditional Name: (4E)-2-(2-methyl-3-nitro-phenyl)-4-(2-nitrobenzylidene)-2-oxazolin-5-one Formula: C17H11N3O6 MolecularWeight: 353.28574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C2=NC(=CC3=CC=CC=C3[N+](=O)[O-])C(=O)O2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C2=N/C(=C/C3=CC=CC=C3[N+](=O)[O-])/C(=O)O2

InChI

InChI=1S/C17H11N3O6/c1-10-12(6-4-8-14(10)19(22)23)16-18-13(17(21)26-16)9-11-5-2-3-7-15(11)20(24)25/h2-9H,1H3/b13-9+