3-pyridin-4-ylpropyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: 3-pyridin-4-ylpropyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: 3-(4-pyridyl)propyl 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid 3-(4-pyridyl)propyl ester Formula: C17H19ClN2O4S MolecularWeight: 382.86176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCCCC2=CC=NC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCCCC2=CC=NC=C2

InChI

InChI=1S/C17H19ClN2O4S/c1-20(2)25(22,23)14-5-6-16(18)15(12-14)17(21)24-11-3-4-13-7-9-19-10-8-13/h5-10,12H,3-4,11H2,1-2H3