cyanomethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: cyanomethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: cyanomethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(diethylsulfamoyl)-2-pyrrolidino-benzoic acid cyanomethyl ester Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC#N

InChI

InChI=1S/C17H23N3O4S/c1-3-20(4-2)25(22,23)14-7-8-16(19-10-5-6-11-19)15(13-14)17(21)24-12-9-18/h7-8,13H,3-6,10-12H2,1-2H3