3-(3-azanyl-3-oxidanylidene-propyl)sulfonyl-2,6-bis(fluoranyl)benzoic acid

Systemtic Name: 3-(3-azanyl-3-oxidanylidene-propyl)sulfonyl-2,6-bis(fluoranyl)benzoic acid Openeye Name: 3-(3-amino-3-oxo-propyl)sulfonyl-2,6-difluoro-benzoic acid CAS Name: 3-(3-amino-3-oxopropyl)sulfonyl-2,6-difluorobenzoic acid IUPAC Name: 3-(3-amino-3-oxopropyl)sulfonyl-2,6-difluorobenzoic acid Traditional Name: 3-(3-amino-3-keto-propyl)sulfonyl-2,6-difluoro-benzoic acid Formula: C10H9F2NO5S MolecularWeight: 293.243966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1F)C(=O)O)F)S(=O)(=O)CCC(=O)N

Isomeric SMILES

C1=CC(=C(C(=C1F)C(=O)O)F)S(=O)(=O)CCC(=O)N

InChI

InChI=1S/C10H9F2NO5S/c11-5-1-2-6(9(12)8(5)10(15)16)19(17,18)4-3-7(13)14/h1-2H,3-4H2,(H2,13,14)(H,15,16)