(2-propanoylphenyl) 4-ethoxybenzenesulfonate

Systemtic Name: (2-propanoylphenyl) 4-ethoxybenzenesulfonate Openeye Name: (2-propanoylphenyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid [2-(1-oxopropyl)phenyl] ester IUPAC Name: (2-propanoylphenyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (2-propionylphenyl) ester Formula: C17H18O5S MolecularWeight: 334.38682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCC(=O)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C17H18O5S/c1-3-16(18)15-7-5-6-8-17(15)22-23(19,20)14-11-9-13(10-12-14)21-4-2/h5-12H,3-4H2,1-2H3