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

Systemtic Name: N-[2-(2-bromanyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-cyclohexylphenoxy)ethanamide Openeye Name: N-[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-2-(4-cyclohexylphenoxy)acetamide CAS Name: N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-2-(4-cyclohexylphenoxy)acetamide IUPAC Name: N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-2-(4-cyclohexylphenoxy)acetamide Traditional Name: N-[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-2-(4-cyclohexylphenoxy)acetamide Formula: C27H24BrIN2O3 MolecularWeight: 631.29953

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)I)Br

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)I)Br

InChI

InChI=1S/C27H24BrIN2O3/c28-23-12-8-19(29)14-22(23)27-31-24-15-20(9-13-25(24)34-27)30-26(32)16-33-21-10-6-18(7-11-21)17-4-2-1-3-5-17/h6-15,17H,1-5,16H2,(H,30,32)