N,N-bis(2-cyanoethyl)-2-iodanyl-benzamide

Systemtic Name: N,N-bis(2-cyanoethyl)-2-iodanyl-benzamide Openeye Name: N,N-bis(2-cyanoethyl)-2-iodo-benzamide CAS Name: N,N-bis(2-cyanoethyl)-2-iodobenzamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-iodobenzamide Traditional Name: N,N-bis(2-cyanoethyl)-2-iodo-benzamide Formula: C13H12IN3O MolecularWeight: 353.15835

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12IN3O/c14-12-6-2-1-5-11(12)13(18)17(9-3-7-15)10-4-8-16/h1-2,5-6H,3-4,9-10H2