[4-[[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-ethoxy-6-iodanyl-phenyl] propanoate

Systemtic Name: [4-[[2-(4-tert-butylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-ethoxy-6-iodanyl-phenyl] propanoate Openeye Name: [4-[[2-(4-tert-butylphenyl)-5-oxo-oxazol-4-ylidene]methyl]-2-ethoxy-6-iodo-phenyl] propanoate CAS Name: propanoic acid [4-[[2-(4-tert-butylphenyl)-5-oxo-4-oxazolylidene]methyl]-2-ethoxy-6-iodophenyl] ester IUPAC Name: [4-[[2-(4-tert-butylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-ethoxy-6-iodophenyl] propanoate Traditional Name: propionic acid [4-[[2-(4-tert-butylphenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-2-ethoxy-6-iodo-phenyl] ester Formula: C25H26INO5 MolecularWeight: 547.38211

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1I)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)C(C)(C)C)OCC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1I)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)C(C)(C)C)OCC

InChI

InChI=1S/C25H26INO5/c1-6-21(28)31-22-18(26)12-15(14-20(22)30-7-2)13-19-24(29)32-23(27-19)16-8-10-17(11-9-16)25(3,4)5/h8-14H,6-7H2,1-5H3