2-(3,4-dimethylphenoxy)-N-[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]ethanamide

Systemtic Name: 2-(3,4-dimethylphenoxy)-N-[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]ethanamide Openeye Name: 2-(3,4-dimethylphenoxy)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]acetamide CAS Name: 2-(3,4-dimethylphenoxy)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]acetamide IUPAC Name: 2-(3,4-dimethylphenoxy)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]acetamide Traditional Name: 2-(3,4-dimethylphenoxy)-N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]acetamide Formula: C23H19IN2O3 MolecularWeight: 498.31303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)I)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)I)C

InChI

InChI=1S/C23H19IN2O3/c1-14-6-8-19(10-15(14)2)28-13-22(27)25-18-7-9-21-20(12-18)26-23(29-21)16-4-3-5-17(24)11-16/h3-12H,13H2,1-2H3,(H,25,27)