3-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfonyl-2,6-bis(fluoranyl)benzoic acid

Systemtic Name: 3-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfonyl-2,6-bis(fluoranyl)benzoic acid Openeye Name: 2,6-difluoro-3-(2-oxo-2-ureido-ethyl)sulfonyl-benzoic acid CAS Name: 3-[2-(carbamoylamino)-2-oxoethyl]sulfonyl-2,6-difluorobenzoic acid IUPAC Name: 3-[2-(carbamoylamino)-2-oxoethyl]sulfonyl-2,6-difluorobenzoic acid Traditional Name: 2,6-difluoro-3-(2-keto-2-ureido-ethyl)sulfonyl-benzoic acid Formula: C10H8F2N2O6S MolecularWeight: 322.242126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8F2N2O6S/c11-4-1-2-5(8(12)7(4)9(16)17)21(19,20)3-6(15)14-10(13)18/h1-2H,3H2,(H,16,17)(H3,13,14,15,18)