[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-(4-besylpiperazino)-2-keto-ethyl] ester Formula: C19H20FN3O7S2 MolecularWeight: 485.506403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN3O7S2/c20-17-7-6-15(31(21,26)27)12-16(17)19(25)30-13-18(24)22-8-10-23(11-9-22)32(28,29)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H2,21,26,27)