pyridin-2-ylmethyl 5-(diethylsulfamoyl)-2-methyl-benzoate

Systemtic Name: pyridin-2-ylmethyl 5-(diethylsulfamoyl)-2-methyl-benzoate Openeye Name: 2-pyridylmethyl 5-(diethylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(diethylsulfamoyl)-2-methylbenzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 5-(diethylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(diethylsulfamoyl)-2-methyl-benzoic acid 2-pyridylmethyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)OCC2=CC=CC=N2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C18H22N2O4S/c1-4-20(5-2)25(22,23)16-10-9-14(3)17(12-16)18(21)24-13-15-8-6-7-11-19-15/h6-12H,4-5,13H2,1-3H3