4-[(3-bromanyl-4,5-diethoxy-phenyl)methylidene]-2-(2-chloranyl-4-nitro-phenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[(3-bromanyl-4,5-diethoxy-phenyl)methylidene]-2-(2-chloranyl-4-nitro-phenyl)-1,3-oxazol-5-one Openeye Name: 4-[(3-bromo-4,5-diethoxy-phenyl)methylene]-2-(2-chloro-4-nitro-phenyl)oxazol-5-one CAS Name: 4-[(3-bromo-4,5-diethoxyphenyl)methylidene]-2-(2-chloro-4-nitrophenyl)-5-oxazolone IUPAC Name: 4-[(3-bromo-4,5-diethoxyphenyl)methylidene]-2-(2-chloro-4-nitrophenyl)-1,3-oxazol-5-one Traditional Name: 4-(3-bromo-4,5-diethoxy-benzylidene)-2-(2-chloro-4-nitro-phenyl)-2-oxazolin-5-one Formula: C20H16BrClN2O6 MolecularWeight: 495.70784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)Br)OCC

InChI

InChI=1S/C20H16BrClN2O6/c1-3-28-17-9-11(7-14(21)18(17)29-4-2)8-16-20(25)30-19(23-16)13-6-5-12(24(26)27)10-15(13)22/h5-10H,3-4H2,1-2H3