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

Systemtic Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[2-(4-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C15H14BrFN2O3 MolecularWeight: 369.185663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)COC(=O)C2=CC(=CN2)Br)F

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)COC(=O)C2=CC(=CN2)Br)F

InChI

InChI=1S/C15H14BrFN2O3/c16-11-7-13(19-8-11)15(21)22-9-14(20)18-6-5-10-1-3-12(17)4-2-10/h1-4,7-8,19H,5-6,9H2,(H,18,20)