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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)OC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C20H16BrClN2O6/c1-3-6-29-18-14(21)7-11(9-17(18)28-2)8-16-20(25)30-19(23-16)13-10-12(24(26)27)4-5-15(13)22/h4-5,7-10H,3,6H2,1-2H3