3-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfonylethoxy]benzoic acid

Systemtic Name: 3-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfonylethoxy]benzoic acid Openeye Name: 3-[2-(2-ethoxy-2-oxo-ethyl)sulfonylethoxy]benzoic acid CAS Name: 3-[2-(2-ethoxy-2-oxoethyl)sulfonylethoxy]benzoic acid IUPAC Name: 3-[2-(2-ethoxy-2-oxoethyl)sulfonylethoxy]benzoic acid Traditional Name: 3-[2-(2-ethoxy-2-keto-ethyl)sulfonylethoxy]benzoic acid Formula: C13H16O7S MolecularWeight: 316.32694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)CCOC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CCOC(=O)CS(=O)(=O)CCOC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C13H16O7S/c1-2-19-12(14)9-21(17,18)7-6-20-11-5-3-4-10(8-11)13(15)16/h3-5,8H,2,6-7,9H2,1H3,(H,15,16)