3-ethoxy-3-oxidanylidene-1-phenyl-propane-1-sulfonate

Systemtic Name: 3-ethoxy-3-oxidanylidene-1-phenyl-propane-1-sulfonate Openeye Name: 3-ethoxy-3-oxo-1-phenyl-propane-1-sulfonate CAS Name: 3-ethoxy-3-oxo-1-phenyl-1-propanesulfonate IUPAC Name: 3-ethoxy-3-oxo-1-phenylpropane-1-sulfonate Traditional Name: 3-ethoxy-3-keto-1-phenyl-propane-1-sulfonate Formula: C11H13O5S- MolecularWeight: 257.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C11H14O5S/c1-2-16-11(12)8-10(17(13,14)15)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3,(H,13,14,15)/p-1