[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-fluoranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-fluoranyl-5-sulfamoyl-benzoate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-fluoro-5-sulfamoyl-benzoate CAS Name: 2-fluoro-5-sulfamoylbenzoic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] 2-fluoro-5-sulfamoylbenzoate Traditional Name: 2-fluoro-5-sulfamoyl-benzoic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C18H19FN2O5S MolecularWeight: 394.417263

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)F)C2=CC=CC=C2

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)F)C2=CC=CC=C2

InChI

InChI=1S/C18H19FN2O5S/c1-12(13-5-3-2-4-6-13)10-21-17(22)11-26-18(23)15-9-14(27(20,24)25)7-8-16(15)19/h2-9,12H,10-11H2,1H3,(H,21,22)(H2,20,24,25)/t12-/m1/s1