3-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfonyl-4-fluoranyl-benzoic acid

Systemtic Name: 3-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 4-fluoro-3-(2-oxo-2-ureido-ethyl)sulfonyl-benzoic acid CAS Name: 3-[2-(carbamoylamino)-2-oxoethyl]sulfonyl-4-fluorobenzoic acid IUPAC Name: 3-[2-(carbamoylamino)-2-oxoethyl]sulfonyl-4-fluorobenzoic acid Traditional Name: 4-fluoro-3-(2-keto-2-ureido-ethyl)sulfonyl-benzoic acid Formula: C10H9FN2O6S MolecularWeight: 304.251663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC(=O)NC(=O)N)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC(=O)NC(=O)N)F

InChI

InChI=1S/C10H9FN2O6S/c11-6-2-1-5(9(15)16)3-7(6)20(18,19)4-8(14)13-10(12)17/h1-3H,4H2,(H,15,16)(H3,12,13,14,17)