[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-bromanyl-4-fluoranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-bromanyl-4-fluoranyl-benzoate Openeye Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-bromo-4-fluoro-benzoate CAS Name: 2-bromo-4-fluorobenzoic acid [2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-bromo-4-fluorobenzoate Traditional Name: 2-bromo-4-fluoro-benzoic acid [2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] ester Formula: C15H15BrFN3O3 MolecularWeight: 384.200303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)COC(=O)C2=C(C=C(C=C2)F)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)COC(=O)C2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C15H15BrFN3O3/c1-8-14(9(2)20(3)19-8)18-13(21)7-23-15(22)11-5-4-10(17)6-12(11)16/h4-6H,7H2,1-3H3,(H,18,21)