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

Systemtic Name: ethyl 4-[(4-bromanyl-2-fluoranyl-phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(4-bromo-2-fluoro-phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(4-bromo-2-fluoroanilino)-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-bromo-2-fluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(4-bromo-2-fluoro-phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C16H16BrFN2O3 MolecularWeight: 383.212243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=C(C=C(C=C2)Br)F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=C(C=C(C=C2)Br)F)C

InChI

InChI=1S/C16H16BrFN2O3/c1-4-23-16(22)14-8(2)13(9(3)19-14)15(21)20-12-6-5-10(17)7-11(12)18/h5-7,19H,4H2,1-3H3,(H,20,21)