6-(2-cyanoethyl)-2-iodanyl-3-oxidanyl-benzamide

Systemtic Name: 6-(2-cyanoethyl)-2-iodanyl-3-oxidanyl-benzamide Openeye Name: 6-(2-cyanoethyl)-3-hydroxy-2-iodo-benzamide CAS Name: 6-(2-cyanoethyl)-3-hydroxy-2-iodobenzamide IUPAC Name: 6-(2-cyanoethyl)-3-hydroxy-2-iodobenzamide Traditional Name: 6-(2-cyanoethyl)-3-hydroxy-2-iodo-benzamide Formula: C10H9IN2O2 MolecularWeight: 316.09513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1CCC#N)C(=O)N)I)O

Isomeric SMILES

C1=CC(=C(C(=C1CCC#N)C(=O)N)I)O

InChI

InChI=1S/C10H9IN2O2/c11-9-7(14)4-3-6(2-1-5-12)8(9)10(13)15/h3-4,14H,1-2H2,(H2,13,15)