methyl 2-[2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]ethanoate Openeye Name: methyl 2-[2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]acetate CAS Name: 2-[[2-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]acetate Traditional Name: 2-[2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]acetic acid methyl ester Formula: C11H13BrF3N3O3 MolecularWeight: 372.13843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NCC(=O)OC)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NCC(=O)OC)C(F)(F)F)Br

InChI

InChI=1S/C11H13BrF3N3O3/c1-5-8(12)9(11(13,14)15)17-18(5)6(2)10(20)16-4-7(19)21-3/h6H,4H2,1-3H3,(H,16,20)