3-[[3,4-bis(fluoranyl)phenyl]-ethylsulfonyl-amino]propanoic acid

Systemtic Name: 3-[[3,4-bis(fluoranyl)phenyl]-ethylsulfonyl-amino]propanoic acid Openeye Name: 3-(N-ethylsulfonyl-3,4-difluoro-anilino)propanoic acid CAS Name: 3-(N-ethylsulfonyl-3,4-difluoroanilino)propanoic acid IUPAC Name: 3-(N-ethylsulfonyl-3,4-difluoroanilino)propanoic acid Traditional Name: 3-(N-esyl-3,4-difluoro-anilino)propionic acid Formula: C11H13F2NO4S MolecularWeight: 293.287026

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CCC(=O)O)C1=CC(=C(C=C1)F)F

Isomeric SMILES

CCS(=O)(=O)N(CCC(=O)O)C1=CC(=C(C=C1)F)F

InChI

InChI=1S/C11H13F2NO4S/c1-2-19(17,18)14(6-5-11(15)16)8-3-4-9(12)10(13)7-8/h3-4,7H,2,5-6H2,1H3,(H,15,16)