2-[methylsulfonyl-[3-(trifluoromethyl)phenyl]amino]propanoic acid

Systemtic Name: 2-[methylsulfonyl-[3-(trifluoromethyl)phenyl]amino]propanoic acid Openeye Name: 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]propanoic acid CAS Name: 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]propanoic acid IUPAC Name: 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]propanoic acid Traditional Name: 2-[N-mesyl-3-(trifluoromethyl)anilino]propionic acid Formula: C11H12F3NO4S MolecularWeight: 311.27749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=CC(=C1)C(F)(F)F)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)N(C1=CC=CC(=C1)C(F)(F)F)S(=O)(=O)C

InChI

InChI=1S/C11H12F3NO4S/c1-7(10(16)17)15(20(2,18)19)9-5-3-4-8(6-9)11(12,13)14/h3-7H,1-2H3,(H,16,17)