(4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodanylphenyl)-1,3-oxazol-5-one

Systemtic Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodanylphenyl)-1,3-oxazol-5-one Openeye Name: (4E)-4-(1,3-benzodioxol-5-ylmethylene)-2-(3-iodophenyl)oxazol-5-one CAS Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodophenyl)-5-oxazolone IUPAC Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodophenyl)-1,3-oxazol-5-one Traditional Name: (4E)-2-(3-iodophenyl)-4-piperonylidene-2-oxazolin-5-one Formula: C17H10INO4 MolecularWeight: 419.17007

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC(=CC=C4)I

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/3\C(=O)OC(=N3)C4=CC(=CC=C4)I

InChI

InChI=1S/C17H10INO4/c18-12-3-1-2-11(8-12)16-19-13(17(20)23-16)6-10-4-5-14-15(7-10)22-9-21-14/h1-8H,9H2/b13-6+