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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11N3O6/c1-10-2-5-12(9-15(10)20(24)25)16-18-14(17(21)26-16)8-11-3-6-13(7-4-11)19(22)23/h2-9H,1H3/b14-8+