[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(4-fluorophenyl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(4-fluorophenyl)sulfonylamino]benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(4-fluorophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-fluorophenyl)sulfonylamino]benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(4-fluorophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-fluorophenyl)sulfonylamino]benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H15FN2O5S MolecularWeight: 390.385503

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H15FN2O5S/c1-2-11-20-17(22)12-26-18(23)15-5-3-4-6-16(15)21-27(24,25)14-9-7-13(19)8-10-14/h1,3-10,21H,11-12H2,(H,20,22)