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

Systemtic Name: (2-methyl-2-oxidanyl-3-oxidanylidene-3-phenyl-propyl) 4-ethoxybenzenesulfonate Openeye Name: (2-hydroxy-2-methyl-3-oxo-3-phenyl-propyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (2-hydroxy-2-methyl-3-oxo-3-phenylpropyl) ester IUPAC Name: (2-hydroxy-2-methyl-3-oxo-3-phenylpropyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (2-hydroxy-3-keto-2-methyl-3-phenyl-propyl) ester Formula: C18H20O6S MolecularWeight: 364.4128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C18H20O6S/c1-3-23-15-9-11-16(12-10-15)25(21,22)24-13-18(2,20)17(19)14-7-5-4-6-8-14/h4-12,20H,3,13H2,1-2H3