methyl 2-[[4-bromanyl-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-bromanyl-2-methyl-5-(trifluoromethyl)pyrazol-3-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-bromo-2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]acetate CAS Name: 2-[[[4-bromo-2-methyl-5-(trifluoromethyl)-3-pyrazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-bromo-2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]acetate Traditional Name: 2-[[4-bromo-2-methyl-5-(trifluoromethyl)pyrazole-3-carbonyl]amino]acetic acid methyl ester Formula: C9H9BrF3N3O3 MolecularWeight: 344.08527

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NCC(=O)OC

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NCC(=O)OC

InChI

InChI=1S/C9H9BrF3N3O3/c1-16-6(8(18)14-3-4(17)19-2)5(10)7(15-16)9(11,12)13/h3H2,1-2H3,(H,14,18)