N-(3-ethanoylphenyl)-2-(4-iodanylpyrazol-1-yl)ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(4-iodanylpyrazol-1-yl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-(4-iodopyrazol-1-yl)acetamide CAS Name: N-(3-acetylphenyl)-2-(4-iodo-1-pyrazolyl)acetamide IUPAC Name: N-(3-acetylphenyl)-2-(4-iodopyrazol-1-yl)acetamide Traditional Name: N-(3-acetylphenyl)-2-(4-iodopyrazol-1-yl)acetamide Formula: C13H12IN3O2 MolecularWeight: 369.15775

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CN2C=C(C=N2)I

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CN2C=C(C=N2)I

InChI

InChI=1S/C13H12IN3O2/c1-9(18)10-3-2-4-12(5-10)16-13(19)8-17-7-11(14)6-15-17/h2-7H,8H2,1H3,(H,16,19)