N-(1,3-benzodioxol-5-ylmethyl)-2-(4-iodanylpyrazol-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-iodanylpyrazol-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-iodopyrazol-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-iodo-1-pyrazolyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-iodopyrazol-1-yl)acetamide Traditional Name: 2-(4-iodopyrazol-1-yl)-N-piperonyl-acetamide Formula: C13H12IN3O3 MolecularWeight: 385.15715

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C=C(C=N3)I

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN3C=C(C=N3)I

InChI

InChI=1S/C13H12IN3O3/c14-10-5-16-17(6-10)7-13(18)15-4-9-1-2-11-12(3-9)20-8-19-11/h1-3,5-6H,4,7-8H2,(H,15,18)