ethyl 5-[(5-chloranyl-2-iodanyl-phenyl)carbonylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(5-chloranyl-2-iodanyl-phenyl)carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(5-chloro-2-iodo-benzoyl)amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[(5-chloro-2-iodophenyl)-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(5-chloro-2-iodobenzoyl)amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[(5-chloro-2-iodo-benzoyl)amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C19H15ClIN3O3 MolecularWeight: 495.69817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)Cl)I

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)Cl)I

InChI

InChI=1S/C19H15ClIN3O3/c1-2-27-19(26)15-11-22-24(13-6-4-3-5-7-13)17(15)23-18(25)14-10-12(20)8-9-16(14)21/h3-11H,2H2,1H3,(H,23,25)