[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 1H-pyrazole-5-carboxylate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 1H-pyrazole-5-carboxylate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C12H10IN3O3 MolecularWeight: 371.13057

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)NC(=O)COC(=O)C2=CC=NN2

Isomeric SMILES

C1=CC(=CC(=C1)I)NC(=O)COC(=O)C2=CC=NN2

InChI

InChI=1S/C12H10IN3O3/c13-8-2-1-3-9(6-8)15-11(17)7-19-12(18)10-4-5-14-16-10/h1-6H,7H2,(H,14,16)(H,15,17)