3,5-bis(bromanyl)-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodanyl-benzamide

Systemtic Name: 3,5-bis(bromanyl)-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodanyl-benzamide Openeye Name: 3,5-dibromo-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodo-benzamide CAS Name: 3,5-dibromo-N-[2-(4-ethylphenyl)-5-benzotriazolyl]-2-iodobenzamide IUPAC Name: 3,5-dibromo-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide Traditional Name: 3,5-dibromo-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodo-benzamide Formula: C21H15Br2IN4O MolecularWeight: 626.08247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC(=C4I)Br)Br

Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC(=C4I)Br)Br

InChI

InChI=1S/C21H15Br2IN4O/c1-2-12-3-6-15(7-4-12)28-26-18-8-5-14(11-19(18)27-28)25-21(29)16-9-13(22)10-17(23)20(16)24/h3-11H,2H2,1H3,(H,25,29)