3-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfonyl-5-fluoranyl-4-methyl-benzoic acid

Systemtic Name: 3-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfonyl-5-fluoranyl-4-methyl-benzoic acid Openeye Name: 3-fluoro-4-methyl-5-(2-oxo-2-ureido-ethyl)sulfonyl-benzoic acid CAS Name: 3-[2-(carbamoylamino)-2-oxoethyl]sulfonyl-5-fluoro-4-methylbenzoic acid IUPAC Name: 3-[2-(carbamoylamino)-2-oxoethyl]sulfonyl-5-fluoro-4-methylbenzoic acid Traditional Name: 3-fluoro-5-(2-keto-2-ureido-ethyl)sulfonyl-4-methyl-benzoic acid Formula: C11H11FN2O6S MolecularWeight: 318.278243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)CC(=O)NC(=O)N)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)CC(=O)NC(=O)N)C(=O)O)F

InChI

InChI=1S/C11H11FN2O6S/c1-5-7(12)2-6(10(16)17)3-8(5)21(19,20)4-9(15)14-11(13)18/h2-3H,4H2,1H3,(H,16,17)(H3,13,14,15,18)