methyl 2-[2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonylamino]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonylamino]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]acetyl]amino]acetate CAS Name: 2-[[2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]acetyl]amino]acetate Traditional Name: 2-[[2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonylamino]acetyl]amino]acetic acid methyl ester Formula: C12H12BrF3N2O6S MolecularWeight: 449.19769

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CNS(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

Isomeric SMILES

COC(=O)CNC(=O)CNS(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

InChI

InChI=1S/C12H12BrF3N2O6S/c1-23-11(20)6-17-10(19)5-18-25(21,22)9-3-2-7(13)4-8(9)24-12(14,15)16/h2-4,18H,5-6H2,1H3,(H,17,19)