5-[(4-iodophenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: 5-[(4-iodophenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: 5-[(4-iodophenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[(4-iodoanilino)-oxomethyl]-2-methyl-3-pyrazolecarboxylate IUPAC Name: 5-[(4-iodophenyl)carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[(4-iodophenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate Formula: C12H9IN3O3- MolecularWeight: 370.12263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NC2=CC=C(C=C2)I)C(=O)[O-]

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NC2=CC=C(C=C2)I)C(=O)[O-]

InChI

InChI=1S/C12H10IN3O3/c1-16-10(12(18)19)6-9(15-16)11(17)14-8-4-2-7(13)3-5-8/h2-6H,1H3,(H,14,17)(H,18,19)/p-1