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

Systemtic Name: (4E)-4-[(3-bromanyl-4-methoxy-phenyl)methylidene]-2-(4-methyl-3-nitro-phenyl)-1,3-oxazol-5-one Openeye Name: (4E)-4-[(3-bromo-4-methoxy-phenyl)methylene]-2-(4-methyl-3-nitro-phenyl)oxazol-5-one CAS Name: (4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-2-(4-methyl-3-nitrophenyl)-5-oxazolone IUPAC Name: (4E)-4-[(3-bromo-4-methoxyphenyl)methylidene]-2-(4-methyl-3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: (4E)-4-(3-bromo-4-methoxy-benzylidene)-2-(4-methyl-3-nitro-phenyl)-2-oxazolin-5-one Formula: C18H13BrN2O5 MolecularWeight: 417.21022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN2O5/c1-10-3-5-12(9-15(10)21(23)24)17-20-14(18(22)26-17)8-11-4-6-16(25-2)13(19)7-11/h3-9H,1-2H3/b14-8+