2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl 4-fluoranylbenzoate

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl 4-fluoranylbenzoate Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid 2-[4-(benzenesulfonyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid 2-(4-besylpiperazino)ethyl ester Formula: C19H21FN2O4S MolecularWeight: 392.444443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCOC(=O)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21FN2O4S/c20-17-8-6-16(7-9-17)19(23)26-15-14-21-10-12-22(13-11-21)27(24,25)18-4-2-1-3-5-18/h1-9H,10-15H2