[2-(4-ethanoylphenyl)-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(4-ethanoylphenyl)-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-(4-acetylphenyl)-2-oxo-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(4-acetylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetylphenyl)-2-oxoethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(4-acetylphenyl)-2-keto-ethyl] ester Formula: C17H16O5S MolecularWeight: 332.37094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C17H16O5S/c1-12-3-9-16(10-4-12)23(20,21)22-11-17(19)15-7-5-14(6-8-15)13(2)18/h3-10H,11H2,1-2H3