5-[2-(dimethylazaniumyl)ethylsulfamoyl]-2-methyl-benzoate

Systemtic Name: 5-[2-(dimethylazaniumyl)ethylsulfamoyl]-2-methyl-benzoate Openeye Name: 5-[2-(dimethylammonio)ethylsulfamoyl]-2-methyl-benzoate CAS Name: 5-[2-(dimethylammonio)ethylsulfamoyl]-2-methylbenzoate IUPAC Name: 5-[2-(dimethylazaniumyl)ethylsulfamoyl]-2-methylbenzoate Traditional Name: 5-[2-(dimethylammonio)ethylsulfamoyl]-2-methyl-benzoate Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC[NH+](C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC[NH+](C)C)C(=O)[O-]

InChI

InChI=1S/C12H18N2O4S/c1-9-4-5-10(8-11(9)12(15)16)19(17,18)13-6-7-14(2)3/h4-5,8,13H,6-7H2,1-3H3,(H,15,16)