[1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-(phenylsulfonyl)propanoate

Systemtic Name: [1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-(phenylsulfonyl)propanoate Openeye Name: [2-oxo-1,2-bis(p-tolyl)ethyl] 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid [1,2-bis(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [1,2-bis(4-methylphenyl)-2-oxoethyl] 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid [2-keto-1,2-bis(p-tolyl)ethyl] ester Formula: C25H24O5S MolecularWeight: 436.52006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H24O5S/c1-18-8-12-20(13-9-18)24(27)25(21-14-10-19(2)11-15-21)30-23(26)16-17-31(28,29)22-6-4-3-5-7-22/h3-15,25H,16-17H2,1-2H3