[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C13H10BrFN2O3 MolecularWeight: 341.132503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)NC(=O)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

C1=CC(=CC(=C1)F)NC(=O)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H10BrFN2O3/c14-8-4-11(16-6-8)13(19)20-7-12(18)17-10-3-1-2-9(15)5-10/h1-6,16H,7H2,(H,17,18)