2-methyl-5-(pyridin-4-ylmethylsulfamoyl)benzoate

Systemtic Name: 2-methyl-5-(pyridin-4-ylmethylsulfamoyl)benzoate Openeye Name: 2-methyl-5-(4-pyridylmethylsulfamoyl)benzoate CAS Name: 2-methyl-5-(pyridin-4-ylmethylsulfamoyl)benzoate IUPAC Name: 2-methyl-5-(pyridin-4-ylmethylsulfamoyl)benzoate Traditional Name: 2-methyl-5-(4-pyridylmethylsulfamoyl)benzoate Formula: C14H13N2O4S- MolecularWeight: 305.32902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2)C(=O)[O-]

InChI

InChI=1S/C14H14N2O4S/c1-10-2-3-12(8-13(10)14(17)18)21(19,20)16-9-11-4-6-15-7-5-11/h2-8,16H,9H2,1H3,(H,17,18)/p-1