3-cyanopropyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: 3-cyanopropyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: 3-cyanopropyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(diethylsulfamoyl)-2-pyrrolidino-benzoic acid 3-cyanopropyl ester Formula: C19H27N3O4S MolecularWeight: 393.50038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O4S/c1-3-22(4-2)27(24,25)16-9-10-18(21-12-6-7-13-21)17(15-16)19(23)26-14-8-5-11-20/h9-10,15H,3-8,12-14H2,1-2H3