potassium 3-[1-(carboxymethyl)-5-methyl-1,2,4-triazol-3-yl]benzenesulfonate

Systemtic Name: potassium 3-[1-(carboxymethyl)-5-methyl-1,2,4-triazol-3-yl]benzenesulfonate Openeye Name: potassium 3-[1-(carboxymethyl)-5-methyl-1,2,4-triazol-3-yl]benzenesulfonate CAS Name: potassium 3-[1-(carboxymethyl)-5-methyl-1,2,4-triazol-3-yl]benzenesulfonate IUPAC Name: potassium 3-[1-(carboxymethyl)-5-methyl-1,2,4-triazol-3-yl]benzenesulfonate Traditional Name: potassium 3-[1-(carboxymethyl)-5-methyl-1,2,4-triazol-3-yl]besylate Formula: C11H10KN3O5S MolecularWeight: 335.3775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1CC(=O)O)C2=CC(=CC=C2)S(=O)(=O)[O-].[K+]

Isomeric SMILES

CC1=NC(=NN1CC(=O)O)C2=CC(=CC=C2)S(=O)(=O)[O-].[K+]

InChI

InChI=1S/C11H11N3O5S.K/c1-7-12-11(13-14(7)6-10(15)16)8-3-2-4-9(5-8)20(17,18)19;/h2-5H,6H2,1H3,(H,15,16)(H,17,18,19);/q;+1/p-1