N-[cyano(pyrazol-1-yl)methyl]-4-iodanyl-benzamide

Systemtic Name: N-[cyano(pyrazol-1-yl)methyl]-4-iodanyl-benzamide Openeye Name: N-[cyano(pyrazol-1-yl)methyl]-4-iodo-benzamide CAS Name: N-[cyano(1-pyrazolyl)methyl]-4-iodobenzamide IUPAC Name: N-[cyano(pyrazol-1-yl)methyl]-4-iodobenzamide Traditional Name: N-[cyano(pyrazol-1-yl)methyl]-4-iodo-benzamide Formula: C12H9IN4O MolecularWeight: 352.13053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C(C#N)NC(=O)C2=CC=C(C=C2)I

Isomeric SMILES

C1=CN(N=C1)C(C#N)NC(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C12H9IN4O/c13-10-4-2-9(3-5-10)12(18)16-11(8-14)17-7-1-6-15-17/h1-7,11H,(H,16,18)