[1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonyl)propanoate

Systemtic Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 3-(phenylsulfonyl)propanoate Openeye Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid (2-indan-5-yl-2-keto-1-methyl-ethyl) ester Formula: C21H22O5S MolecularWeight: 386.46138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22O5S/c1-15(21(23)18-11-10-16-6-5-7-17(16)14-18)26-20(22)12-13-27(24,25)19-8-3-2-4-9-19/h2-4,8-11,14-15H,5-7,12-13H2,1H3