3-(1,3-benzodioxol-5-yl)-5-[(4-iodanylpyrazol-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodanylpyrazol-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodopyrazol-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodo-1-pyrazolyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodopyrazol-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-[(4-iodopyrazol-1-yl)methyl]-1,2,4-oxadiazole Formula: C13H9IN4O3 MolecularWeight: 396.14003

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NOC(=N3)CN4C=C(C=N4)I

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NOC(=N3)CN4C=C(C=N4)I

InChI

InChI=1S/C13H9IN4O3/c14-9-4-15-18(5-9)6-12-16-13(17-21-12)8-1-2-10-11(3-8)20-7-19-10/h1-5H,6-7H2