1-(2-chlorophenyl)ethyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: 1-(2-chlorophenyl)ethyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: 1-(2-chlorophenyl)ethyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid 1-(2-chlorophenyl)ethyl ester IUPAC Name: 1-(2-chlorophenyl)ethyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-pyrrolidino-benzoic acid 1-(2-chlorophenyl)ethyl ester Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)N3CCCC3

Isomeric SMILES

CC(C1=CC=CC=C1Cl)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)N3CCCC3

InChI

InChI=1S/C21H25ClN2O4S/c1-15(17-8-4-5-9-19(17)22)28-21(25)18-14-16(29(26,27)23(2)3)10-11-20(18)24-12-6-7-13-24/h4-5,8-11,14-15H,6-7,12-13H2,1-3H3