[4-[[2-(4-bromophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-ethoxy-phenyl] propanoate

Systemtic Name: [4-[[2-(4-bromophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-ethoxy-phenyl] propanoate Openeye Name: [4-[[2-(4-bromophenyl)-5-oxo-oxazol-4-ylidene]methyl]-2-ethoxy-phenyl] propanoate CAS Name: propanoic acid [4-[[2-(4-bromophenyl)-5-oxo-4-oxazolylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-ethoxyphenyl] propanoate Traditional Name: propionic acid [4-[[2-(4-bromophenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-2-ethoxy-phenyl] ester Formula: C21H18BrNO5 MolecularWeight: 444.27532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)Br)OCC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)Br)OCC

InChI

InChI=1S/C21H18BrNO5/c1-3-19(24)27-17-10-5-13(12-18(17)26-4-2)11-16-21(25)28-20(23-16)14-6-8-15(22)9-7-14/h5-12H,3-4H2,1-2H3