[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-chloranyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 4-chloro-3-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C16H19ClN2O5S MolecularWeight: 386.85046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)NCC#C)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC(=O)NCC#C)Cl

InChI

InChI=1S/C16H19ClN2O5S/c1-4-9-18-15(20)11-24-16(21)12-7-8-13(17)14(10-12)25(22,23)19(5-2)6-3/h1,7-8,10H,5-6,9,11H2,2-3H3,(H,18,20)