cyanomethyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate

Systemtic Name: cyanomethyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate Openeye Name: cyanomethyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate CAS Name: 4-phenoxy-3-(1-pyrrolidinyl)-5-sulfamoylbenzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoylbenzoate Traditional Name: 4-phenoxy-3-pyrrolidino-5-sulfamoyl-benzoic acid cyanomethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=CC(=C2)C(=O)OCC#N)S(=O)(=O)N)OC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C2=C(C(=CC(=C2)C(=O)OCC#N)S(=O)(=O)N)OC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O5S/c20-8-11-26-19(23)14-12-16(22-9-4-5-10-22)18(17(13-14)28(21,24)25)27-15-6-2-1-3-7-15/h1-3,6-7,12-13H,4-5,9-11H2,(H2,21,24,25)