4-ethyl-2-(4-iodophenyl)-5-methyl-pyrazol-3-olate

Systemtic Name: 4-ethyl-2-(4-iodophenyl)-5-methyl-pyrazol-3-olate Openeye Name: 4-ethyl-2-(4-iodophenyl)-5-methyl-pyrazol-3-olate CAS Name: 4-ethyl-2-(4-iodophenyl)-5-methyl-3-pyrazololate IUPAC Name: 4-ethyl-2-(4-iodophenyl)-5-methylpyrazol-3-olate Traditional Name: 4-ethyl-2-(4-iodophenyl)-5-methyl-pyrazol-3-olate Formula: C12H12IN2O- MolecularWeight: 327.14095

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C)C2=CC=C(C=C2)I)[O-]

Isomeric SMILES

CCC1=C(N(N=C1C)C2=CC=C(C=C2)I)[O-]

InChI

InChI=1S/C12H13IN2O/c1-3-11-8(2)14-15(12(11)16)10-6-4-9(13)5-7-10/h4-7,16H,3H2,1-2H3/p-1