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

Systemtic Name: 4-[[4-(4-tert-butylphenoxy)-3-nitro-phenyl]methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Openeye Name: 4-[[4-(4-tert-butylphenoxy)-3-nitro-phenyl]methylene]-2-(3-nitrophenyl)oxazol-5-one CAS Name: 4-[[4-(4-tert-butylphenoxy)-3-nitrophenyl]methylidene]-2-(3-nitrophenyl)-5-oxazolone IUPAC Name: 4-[[4-(4-tert-butylphenoxy)-3-nitrophenyl]methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: 4-[4-(4-tert-butylphenoxy)-3-nitro-benzylidene]-2-(3-nitrophenyl)-2-oxazolin-5-one Formula: C26H21N3O7 MolecularWeight: 487.46084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H21N3O7/c1-26(2,3)18-8-10-20(11-9-18)35-23-12-7-16(14-22(23)29(33)34)13-21-25(30)36-24(27-21)17-5-4-6-19(15-17)28(31)32/h4-15H,1-3H3