methyl 2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-methyl-amino]acetate CAS Name: 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-methylamino]acetate Traditional Name: 2-[[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-methyl-amino]acetic acid methyl ester Formula: C11H11BrF3NO5S MolecularWeight: 406.17295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)S(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

Isomeric SMILES

CN(CC(=O)OC)S(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F

InChI

InChI=1S/C11H11BrF3NO5S/c1-16(6-10(17)20-2)22(18,19)9-4-3-7(12)5-8(9)21-11(13,14)15/h3-5H,6H2,1-2H3