3-[(2-fluorophenyl)-methylsulfonyl-amino]propanoate

Systemtic Name: 3-[(2-fluorophenyl)-methylsulfonyl-amino]propanoate Openeye Name: 3-(2-fluoro-N-methylsulfonyl-anilino)propanoate CAS Name: 3-(2-fluoro-N-methylsulfonylanilino)propanoate IUPAC Name: 3-(2-fluoro-N-methylsulfonylanilino)propanoate Traditional Name: 3-(2-fluoro-N-mesyl-anilino)propionate Formula: C10H11FNO4S- MolecularWeight: 260.262043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCC(=O)[O-])C1=CC=CC=C1F

Isomeric SMILES

CS(=O)(=O)N(CCC(=O)[O-])C1=CC=CC=C1F

InChI

InChI=1S/C10H12FNO4S/c1-17(15,16)12(7-6-10(13)14)9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,13,14)/p-1