3-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfonyl-4-fluoranyl-benzoic acid

Systemtic Name: 3-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 3-(2-amino-1-methyl-2-oxo-ethyl)sulfonyl-4-fluoro-benzoic acid CAS Name: 3-(1-amino-1-oxopropan-2-yl)sulfonyl-4-fluorobenzoic acid IUPAC Name: 3-(1-amino-1-oxopropan-2-yl)sulfonyl-4-fluorobenzoic acid Traditional Name: 3-(2-amino-2-keto-1-methyl-ethyl)sulfonyl-4-fluoro-benzoic acid Formula: C10H10FNO5S MolecularWeight: 275.253503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10FNO5S/c1-5(9(12)13)18(16,17)8-4-6(10(14)15)2-3-7(8)11/h2-5H,1H3,(H2,12,13)(H,14,15)