4-[(3,4-diethoxy-5-iodanyl-phenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[(3,4-diethoxy-5-iodanyl-phenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Openeye Name: 4-[(3,4-diethoxy-5-iodo-phenyl)methylene]-2-(3-nitrophenyl)oxazol-5-one CAS Name: 4-[(3,4-diethoxy-5-iodophenyl)methylidene]-2-(3-nitrophenyl)-5-oxazolone IUPAC Name: 4-[(3,4-diethoxy-5-iodophenyl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: 4-(3,4-diethoxy-5-iodo-benzylidene)-2-(3-nitrophenyl)-2-oxazolin-5-one Formula: C20H17IN2O6 MolecularWeight: 508.26325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])I)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])I)OCC

InChI

InChI=1S/C20H17IN2O6/c1-3-27-17-10-12(8-15(21)18(17)28-4-2)9-16-20(24)29-19(22-16)13-6-5-7-14(11-13)23(25)26/h5-11H,3-4H2,1-2H3