3-[2-(dimethylazaniumyl)ethylsulfamoyl]-4-methoxy-benzoate

Systemtic Name: 3-[2-(dimethylazaniumyl)ethylsulfamoyl]-4-methoxy-benzoate Openeye Name: 3-[2-(dimethylammonio)ethylsulfamoyl]-4-methoxy-benzoate CAS Name: 3-[2-(dimethylammonio)ethylsulfamoyl]-4-methoxybenzoate IUPAC Name: 3-[2-(dimethylazaniumyl)ethylsulfamoyl]-4-methoxybenzoate Traditional Name: 3-[2-(dimethylammonio)ethylsulfamoyl]-4-methoxy-benzoate Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])OC

Isomeric SMILES

C[NH+](C)CCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])OC

InChI

InChI=1S/C12H18N2O5S/c1-14(2)7-6-13-20(17,18)11-8-9(12(15)16)4-5-10(11)19-3/h4-5,8,13H,6-7H2,1-3H3,(H,15,16)