(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-(prop-2-ynylsulfamoyl)benzoate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 4-(prop-2-ynylsulfamoyl)benzoate CAS Name: 4-(prop-2-ynylsulfamoyl)benzoic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 4-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 4-(propargylsulfamoyl)benzoic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC#C

Isomeric SMILES

CC(C(=O)N1CCCC1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC#C

InChI

InChI=1S/C17H20N2O5S/c1-3-10-18-25(22,23)15-8-6-14(7-9-15)17(21)24-13(2)16(20)19-11-4-5-12-19/h1,6-9,13,18H,4-5,10-12H2,2H3