(4Z)-3-(4-butoxyphenyl)-4-[(3-iodanylphenyl)methylidene]-1,2-oxazol-5-one

Systemtic Name: (4Z)-3-(4-butoxyphenyl)-4-[(3-iodanylphenyl)methylidene]-1,2-oxazol-5-one Openeye Name: (4Z)-3-(4-butoxyphenyl)-4-[(3-iodophenyl)methylene]isoxazol-5-one CAS Name: (4Z)-3-(4-butoxyphenyl)-4-[(3-iodophenyl)methylidene]-5-isoxazolone IUPAC Name: (4Z)-3-(4-butoxyphenyl)-4-[(3-iodophenyl)methylidene]-1,2-oxazol-5-one Traditional Name: (4Z)-3-(4-butoxyphenyl)-4-(3-iodobenzylidene)-2-isoxazolin-5-one Formula: C20H18INO3 MolecularWeight: 447.26629

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NOC(=O)C2=CC3=CC(=CC=C3)I

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C\2=NOC(=O)/C2=C\C3=CC(=CC=C3)I

InChI

InChI=1S/C20H18INO3/c1-2-3-11-24-17-9-7-15(8-10-17)19-18(20(23)25-22-19)13-14-5-4-6-16(21)12-14/h4-10,12-13H,2-3,11H2,1H3/b18-13-