methyl 4-(pyridin-4-ylmethylsulfamoylmethyl)benzoate

Systemtic Name: methyl 4-(pyridin-4-ylmethylsulfamoylmethyl)benzoate Openeye Name: methyl 4-(4-pyridylmethylsulfamoylmethyl)benzoate CAS Name: 4-(pyridin-4-ylmethylsulfamoylmethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(pyridin-4-ylmethylsulfamoylmethyl)benzoate Traditional Name: 4-(4-pyridylmethylsulfamoylmethyl)benzoic acid methyl ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NCC2=CC=NC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C15H16N2O4S/c1-21-15(18)14-4-2-13(3-5-14)11-22(19,20)17-10-12-6-8-16-9-7-12/h2-9,17H,10-11H2,1H3