ethyl 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(3-chloro-4-fluoro-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(3-chloro-4-fluoroanilino)-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-chloro-4-fluorophenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H16ClFN2O3 MolecularWeight: 338.761243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=CC(=C(C=C2)F)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=CC(=C(C=C2)F)Cl)C

InChI

InChI=1S/C16H16ClFN2O3/c1-4-23-16(22)13-8(2)14(19-9(13)3)15(21)20-10-5-6-12(18)11(17)7-10/h5-7,19H,4H2,1-3H3,(H,20,21)