3-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfonylbenzoic acid

Systemtic Name: 3-[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfonylbenzoic acid Openeye Name: 3-(1-methyl-2-oxo-2-ureido-ethyl)sulfonylbenzoic acid CAS Name: 3-[1-(carbamoylamino)-1-oxopropan-2-yl]sulfonylbenzoic acid IUPAC Name: 3-[1-(carbamoylamino)-1-oxopropan-2-yl]sulfonylbenzoic acid Traditional Name: 3-(2-keto-1-methyl-2-ureido-ethyl)sulfonylbenzoic acid Formula: C11H12N2O6S MolecularWeight: 300.28778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O6S/c1-6(9(14)13-11(12)17)20(18,19)8-4-2-3-7(5-8)10(15)16/h2-6H,1H3,(H,15,16)(H3,12,13,14,17)