[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 2-(3-fluorophenyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 2-(3-fluorophenyl)ethanoate Openeye Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl] 2-(3-fluorophenyl)acetate CAS Name: 2-(3-fluorophenyl)acetic acid [2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl] 2-(3-fluorophenyl)acetate Traditional Name: 2-(3-fluorophenyl)acetic acid [2-(4-besylpiperazino)-2-keto-ethyl] ester Formula: C20H21FN2O5S MolecularWeight: 420.454543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC(=O)CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)COC(=O)CC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21FN2O5S/c21-17-6-4-5-16(13-17)14-20(25)28-15-19(24)22-9-11-23(12-10-22)29(26,27)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2