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

Systemtic Name: N-[2-(2-bromanyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-2-(3,4-dimethylphenoxy)ethanamide Openeye Name: N-[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-2-(3,4-dimethylphenoxy)acetamide CAS Name: N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-2-(3,4-dimethylphenoxy)acetamide IUPAC Name: N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-2-(3,4-dimethylphenoxy)acetamide Traditional Name: N-[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-2-(3,4-dimethylphenoxy)acetamide Formula: C23H18BrIN2O3 MolecularWeight: 577.20909

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18BrIN2O3/c1-13-3-6-17(9-14(13)2)29-12-22(28)26-16-5-8-21-20(11-16)27-23(30-21)18-10-15(25)4-7-19(18)24/h3-11H,12H2,1-2H3,(H,26,28)