(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C22H25NO6S MolecularWeight: 431.502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C22H25NO6S/c1-17-7-9-19(10-8-17)30(26,27)16-11-20(24)29-21(18-5-3-2-4-6-18)22(25)23-12-14-28-15-13-23/h2-10,21H,11-16H2,1H3