4-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonylbenzoic acid

Systemtic Name: 4-[2-(methylamino)-2-oxidanylidene-ethyl]sulfonylbenzoic acid Openeye Name: 4-[2-(methylamino)-2-oxo-ethyl]sulfonylbenzoic acid CAS Name: 4-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 4-[2-(methylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 4-[2-keto-2-(methylamino)ethyl]sulfonylbenzoic acid Formula: C10H11NO5S MolecularWeight: 257.26304

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CS(=O)(=O)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CNC(=O)CS(=O)(=O)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C10H11NO5S/c1-11-9(12)6-17(15,16)8-4-2-7(3-5-8)10(13)14/h2-5H,6H2,1H3,(H,11,12)(H,13,14)