(2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl) 4-chloranylbenzenesulfonate

Systemtic Name: (2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl) 4-chloranylbenzenesulfonate Openeye Name: (2-hydroxy-2-methyl-3-oxo-3-phenyl-propyl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid (2-hydroxy-2-methyl-3-oxo-3-phenylpropyl) ester IUPAC Name: (2-hydroxy-2-methyl-3-oxo-3-phenylpropyl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (2-hydroxy-3-keto-2-methyl-3-phenyl-propyl) ester Formula: C16H15ClO5S MolecularWeight: 354.8053

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Descriptors Computed from Structure

Canonical SMILES:

CC(COS(=O)(=O)C1=CC=C(C=C1)Cl)(C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC(COS(=O)(=O)C1=CC=C(C=C1)Cl)(C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H15ClO5S/c1-16(19,15(18)12-5-3-2-4-6-12)11-22-23(20,21)14-9-7-13(17)8-10-14/h2-10,19H,11H2,1H3