2-(4-iodophenyl)-1,5-dimethyl-pyrazol-3-one

Systemtic Name: 2-(4-iodophenyl)-1,5-dimethyl-pyrazol-3-one Openeye Name: 2-(4-iodophenyl)-1,5-dimethyl-pyrazol-3-one CAS Name: 2-(4-iodophenyl)-1,5-dimethyl-3-pyrazolone IUPAC Name: 2-(4-iodophenyl)-1,5-dimethylpyrazol-3-one Traditional Name: 2-(4-iodophenyl)-1,5-dimethyl-3-pyrazolin-3-one Formula: C11H11IN2O MolecularWeight: 314.12231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1C)C2=CC=C(C=C2)I

Isomeric SMILES

CC1=CC(=O)N(N1C)C2=CC=C(C=C2)I

InChI

InChI=1S/C11H11IN2O/c1-8-7-11(15)14(13(8)2)10-5-3-9(12)4-6-10/h3-7H,1-2H3