pyridin-2-ylmethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: pyridin-2-ylmethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: 2-pyridylmethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(diethylsulfamoyl)-2-pyrrolidino-benzoic acid 2-pyridylmethyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC3=CC=CC=N3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C21H27N3O4S/c1-3-24(4-2)29(26,27)18-10-11-20(23-13-7-8-14-23)19(15-18)21(25)28-16-17-9-5-6-12-22-17/h5-6,9-12,15H,3-4,7-8,13-14,16H2,1-2H3