N-[4-[(4-chlorophenyl)-cyano-methyl]-3-cyano-phenyl]-3,5-bis(iodanyl)-2-oxidanyl-benzamide

Systemtic Name: N-[4-[(4-chlorophenyl)-cyano-methyl]-3-cyano-phenyl]-3,5-bis(iodanyl)-2-oxidanyl-benzamide Openeye Name: N-[4-[(4-chlorophenyl)-cyano-methyl]-3-cyano-phenyl]-2-hydroxy-3,5-diiodo-benzamide CAS Name: N-[4-[(4-chlorophenyl)-cyanomethyl]-3-cyanophenyl]-2-hydroxy-3,5-diiodobenzamide IUPAC Name: N-[4-[(4-chlorophenyl)-cyanomethyl]-3-cyanophenyl]-2-hydroxy-3,5-diiodobenzamide Traditional Name: N-[4-[(4-chlorophenyl)-cyano-methyl]-3-cyano-phenyl]-2-hydroxy-3,5-diiodo-benzamide Formula: C22H12ClI2N3O2 MolecularWeight: 639.61152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3O)I)I)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC(=C3O)I)I)C#N)Cl

InChI

InChI=1S/C22H12ClI2N3O2/c23-14-3-1-12(2-4-14)19(11-27)17-6-5-16(7-13(17)10-26)28-22(30)18-8-15(24)9-20(25)21(18)29/h1-9,19,29H,(H,28,30)