2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]propanoic acid

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]propanoic acid Openeye Name: 2-(3-chloro-4-fluoro-N-methylsulfonyl-anilino)propanoic acid CAS Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)propanoic acid IUPAC Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)propanoic acid Traditional Name: 2-(3-chloro-4-fluoro-N-mesyl-anilino)propionic acid Formula: C10H11ClFNO4S MolecularWeight: 295.715043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11ClFNO4S/c1-6(10(14)15)13(18(2,16)17)7-3-4-9(12)8(11)5-7/h3-6H,1-2H3,(H,14,15)