(4Z)-4-[(Z)-2-bromanyl-3-phenyl-prop-2-enylidene]-2-(4-butoxyphenyl)-1,3-oxazol-5-one

Systemtic Name: (4Z)-4-[(Z)-2-bromanyl-3-phenyl-prop-2-enylidene]-2-(4-butoxyphenyl)-1,3-oxazol-5-one Openeye Name: (4Z)-4-[(Z)-2-bromo-3-phenyl-prop-2-enylidene]-2-(4-butoxyphenyl)oxazol-5-one CAS Name: (4Z)-4-[(Z)-2-bromo-3-phenylprop-2-enylidene]-2-(4-butoxyphenyl)-5-oxazolone IUPAC Name: (4Z)-4-[(Z)-2-bromo-3-phenylprop-2-enylidene]-2-(4-butoxyphenyl)-1,3-oxazol-5-one Traditional Name: (4Z)-4-[(Z)-2-bromo-3-phenyl-prop-2-enylidene]-2-(4-butoxyphenyl)-2-oxazolin-5-one Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC(=CC(=CC3=CC=CC=C3)Br)C(=O)O2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=N/C(=C\C(=C\C3=CC=CC=C3)\Br)/C(=O)O2

InChI

InChI=1S/C22H20BrNO3/c1-2-3-13-26-19-11-9-17(10-12-19)21-24-20(22(25)27-21)15-18(23)14-16-7-5-4-6-8-16/h4-12,14-15H,2-3,13H2,1H3/b18-14-,20-15-