ethyl 5-(4-iodophenyl)-1,2-oxazole-4-carboxylate

Systemtic Name: ethyl 5-(4-iodophenyl)-1,2-oxazole-4-carboxylate Openeye Name: ethyl 5-(4-iodophenyl)isoxazole-4-carboxylate CAS Name: 5-(4-iodophenyl)-4-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-iodophenyl)-1,2-oxazole-4-carboxylate Traditional Name: 5-(4-iodophenyl)isoxazole-4-carboxylic acid ethyl ester Formula: C12H10INO3 MolecularWeight: 343.11717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(ON=C1)C2=CC=C(C=C2)I

Isomeric SMILES

CCOC(=O)C1=C(ON=C1)C2=CC=C(C=C2)I

InChI

InChI=1S/C12H10INO3/c1-2-16-12(15)10-7-14-17-11(10)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3