4-[(3-bromanyl-5-ethoxy-4-propoxy-phenyl)methylidene]-2-(2-methylphenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[(3-bromanyl-5-ethoxy-4-propoxy-phenyl)methylidene]-2-(2-methylphenyl)-1,3-oxazol-5-one Openeye Name: 4-[(3-bromo-5-ethoxy-4-propoxy-phenyl)methylene]-2-(o-tolyl)oxazol-5-one CAS Name: 4-[(3-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-2-(2-methylphenyl)-5-oxazolone IUPAC Name: 4-[(3-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-2-(2-methylphenyl)-1,3-oxazol-5-one Traditional Name: 4-(3-bromo-5-ethoxy-4-propoxy-benzylidene)-2-(o-tolyl)-2-oxazolin-5-one Formula: C22H22BrNO4 MolecularWeight: 444.31838

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)OC(=N2)C3=CC=CC=C3C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)OC(=N2)C3=CC=CC=C3C)OCC

InChI

InChI=1S/C22H22BrNO4/c1-4-10-27-20-17(23)11-15(13-19(20)26-5-2)12-18-22(25)28-21(24-18)16-9-7-6-8-14(16)3/h6-9,11-13H,4-5,10H2,1-3H3