N-[2-(2-bromanyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[2-(2-bromanyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxy-benzamide Openeye Name: N-[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxy-benzamide CAS Name: N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide IUPAC Name: N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide Traditional Name: N-[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxy-benzamide Formula: C22H16BrIN2O4 MolecularWeight: 579.18191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Br)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Br)OC

InChI

InChI=1S/C22H16BrIN2O4/c1-28-15-7-12(8-16(11-15)29-2)21(27)25-14-4-6-20-19(10-14)26-22(30-20)17-9-13(24)3-5-18(17)23/h3-11H,1-2H3,(H,25,27)