pyridin-2-ylmethyl 5-(dimethylsulfamoyl)-2-piperidin-1-yl-benzoate

Systemtic Name: pyridin-2-ylmethyl 5-(dimethylsulfamoyl)-2-piperidin-1-yl-benzoate Openeye Name: 2-pyridylmethyl 5-(dimethylsulfamoyl)-2-(1-piperidyl)benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-piperidinyl)benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 5-(dimethylsulfamoyl)-2-piperidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-piperidino-benzoic acid 2-pyridylmethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)OCC3=CC=CC=N3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C20H25N3O4S/c1-22(2)28(25,26)17-9-10-19(23-12-6-3-7-13-23)18(14-17)20(24)27-15-16-8-4-5-11-21-16/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3