5-(2-azanyl-2-oxidanylidene-ethyl)sulfonyl-2-fluoranyl-benzoic acid

Systemtic Name: 5-(2-azanyl-2-oxidanylidene-ethyl)sulfonyl-2-fluoranyl-benzoic acid Openeye Name: 5-(2-amino-2-oxo-ethyl)sulfonyl-2-fluoro-benzoic acid CAS Name: 5-(2-amino-2-oxoethyl)sulfonyl-2-fluorobenzoic acid IUPAC Name: 5-(2-amino-2-oxoethyl)sulfonyl-2-fluorobenzoic acid Traditional Name: 5-(2-amino-2-keto-ethyl)sulfonyl-2-fluoro-benzoic acid Formula: C9H8FNO5S MolecularWeight: 261.226923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)CC(=O)N)C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)CC(=O)N)C(=O)O)F

InChI

InChI=1S/C9H8FNO5S/c10-7-2-1-5(3-6(7)9(13)14)17(15,16)4-8(11)12/h1-3H,4H2,(H2,11,12)(H,13,14)