2-(4-bromophenyl)-4-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-1,3-oxazol-5-one

Systemtic Name: 2-(4-bromophenyl)-4-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-1,3-oxazol-5-one Openeye Name: 2-(4-bromophenyl)-4-[[3-(2,4-dinitrophenoxy)phenyl]methylene]oxazol-5-one CAS Name: 2-(4-bromophenyl)-4-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-5-oxazolone IUPAC Name: 2-(4-bromophenyl)-4-[[3-(2,4-dinitrophenoxy)phenyl]methylidene]-1,3-oxazol-5-one Traditional Name: 2-(4-bromophenyl)-4-[3-(2,4-dinitrophenoxy)benzylidene]-2-oxazolin-5-one Formula: C22H12BrN3O7 MolecularWeight: 510.25058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H12BrN3O7/c23-15-6-4-14(5-7-15)21-24-18(22(27)33-21)11-13-2-1-3-17(10-13)32-20-9-8-16(25(28)29)12-19(20)26(30)31/h1-12H