(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 3-(benzylsulfamoyl)-4-chloro-benzoate CAS Name: 4-chloro-3-[(phenylmethyl)sulfamoyl]benzoic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 3-(benzylsulfamoyl)-4-chlorobenzoate Traditional Name: 3-(benzylsulfamoyl)-4-chloro-benzoic acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCCC1)OC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23ClN2O5S/c1-15(20(25)24-11-5-6-12-24)29-21(26)17-9-10-18(22)19(13-17)30(27,28)23-14-16-7-3-2-4-8-16/h2-4,7-10,13,15,23H,5-6,11-12,14H2,1H3