3-(4-fluoranylphenoxy)propyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: 3-(4-fluorophenoxy)propyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-pyrrolidino-benzoic acid 3-(4-fluorophenoxy)propyl ester Formula: C22H27FN2O5S MolecularWeight: 450.523583

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCCCOC3=CC=C(C=C3)F

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C22H27FN2O5S/c1-24(2)31(27,28)19-10-11-21(25-12-3-4-13-25)20(16-19)22(26)30-15-5-14-29-18-8-6-17(23)7-9-18/h6-11,16H,3-5,12-15H2,1-2H3