4-iodanyl-3,5-dimethoxy-1-(phenylmethyl)pyrazole

Systemtic Name: 4-iodanyl-3,5-dimethoxy-1-(phenylmethyl)pyrazole Openeye Name: 1-benzyl-4-iodo-3,5-dimethoxy-pyrazole CAS Name: 4-iodo-3,5-dimethoxy-1-(phenylmethyl)pyrazole IUPAC Name: 1-benzyl-4-iodo-3,5-dimethoxypyrazole Traditional Name: 1-benzyl-4-iodo-3,5-dimethoxy-pyrazole Formula: C12H13IN2O2 MolecularWeight: 344.14829

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NN1CC2=CC=CC=C2)OC)I

Isomeric SMILES

COC1=C(C(=NN1CC2=CC=CC=C2)OC)I

InChI

InChI=1S/C12H13IN2O2/c1-16-11-10(13)12(17-2)15(14-11)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3