phenyl 3-(2-hydroxyphenyl)-3-oxidanylidene-propane-1-sulfonate

Systemtic Name: phenyl 3-(2-hydroxyphenyl)-3-oxidanylidene-propane-1-sulfonate Openeye Name: phenyl 3-(2-hydroxyphenyl)-3-oxo-propane-1-sulfonate CAS Name: 3-(2-hydroxyphenyl)-3-oxo-1-propanesulfonic acid IUPAC Name: phenyl 3-(2-hydroxyphenyl)-3-oxopropane-1-sulfonate Traditional Name: 3-(2-hydroxyphenyl)-3-keto-propane-1-sulfonic acid phenyl ester Formula: C15H14O5S MolecularWeight: 306.33366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)CCC(=O)C2=CC=CC=C2O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)CCC(=O)C2=CC=CC=C2O

InChI

InChI=1S/C15H14O5S/c16-14-9-5-4-8-13(14)15(17)10-11-21(18,19)20-12-6-2-1-3-7-12/h1-9,16H,10-11H2