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

Systemtic Name: (4E)-4-[(4-bromophenyl)methylidene]-2-(2-methyl-3-nitro-phenyl)-1,3-oxazol-5-one Openeye Name: (4E)-4-[(4-bromophenyl)methylene]-2-(2-methyl-3-nitro-phenyl)oxazol-5-one CAS Name: (4E)-4-[(4-bromophenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-5-oxazolone IUPAC Name: (4E)-4-[(4-bromophenyl)methylidene]-2-(2-methyl-3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: (4E)-4-(4-bromobenzylidene)-2-(2-methyl-3-nitro-phenyl)-2-oxazolin-5-one Formula: C17H11BrN2O4 MolecularWeight: 387.18424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11BrN2O4/c1-10-13(3-2-4-15(10)20(22)23)16-19-14(17(21)24-16)9-11-5-7-12(18)8-6-11/h2-9H,1H3/b14-9+