2-[[3-bromanyl-5-(trifluoromethyl)phenyl]methylsulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[3-bromanyl-5-(trifluoromethyl)phenyl]methylsulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[[3-bromo-5-(trifluoromethyl)phenyl]methylsulfonyl-methyl-amino]acetic acid CAS Name: 2-[[3-bromo-5-(trifluoromethyl)phenyl]methylsulfonyl-methylamino]acetic acid IUPAC Name: 2-[[3-bromo-5-(trifluoromethyl)phenyl]methylsulfonyl-methylamino]acetic acid Traditional Name: 2-[[3-bromo-5-(trifluoromethyl)benzyl]sulfonyl-methyl-amino]acetic acid Formula: C11H11BrF3NO4S MolecularWeight: 390.17355

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)S(=O)(=O)CC1=CC(=CC(=C1)Br)C(F)(F)F

Isomeric SMILES

CN(CC(=O)O)S(=O)(=O)CC1=CC(=CC(=C1)Br)C(F)(F)F

InChI

InChI=1S/C11H11BrF3NO4S/c1-16(5-10(17)18)21(19,20)6-7-2-8(11(13,14)15)4-9(12)3-7/h2-4H,5-6H2,1H3,(H,17,18)