N-[2-(3-bromanyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2,5-bis(iodanyl)benzamide

Systemtic Name: N-[2-(3-bromanyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2,5-bis(iodanyl)benzamide Openeye Name: N-[2-(3-bromo-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2,5-diiodo-benzamide CAS Name: N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide IUPAC Name: N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide Traditional Name: N-[2-(3-bromo-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2,5-diiodo-benzamide Formula: C21H13BrI2N2O2 MolecularWeight: 659.05306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)I)I)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)I)I)Br

InChI

InChI=1S/C21H13BrI2N2O2/c1-11-2-3-12(8-16(11)22)21-26-18-10-14(5-7-19(18)28-21)25-20(27)15-9-13(23)4-6-17(15)24/h2-10H,1H3,(H,25,27)