sodium 2-[(E)-[tert-butyl(oxidanidyl)azaniumylidene]methyl]benzenesulfonate

Systemtic Name: sodium 2-[(E)-[tert-butyl(oxidanidyl)azaniumylidene]methyl]benzenesulfonate Openeye Name: sodium 2-[(E)-[tert-butyl(oxido)iminio]methyl]benzenesulfonate CAS Name: sodium 2-[(E)-[tert-butyl(oxido)iminio]methyl]benzenesulfonate IUPAC Name: sodium 2-[(E)-[tert-butyl(oxido)azaniumylidene]methyl]benzenesulfonate Traditional Name: sodium 2-[(E)-[tert-butyl(oxido)iminio]methyl]besylate Formula: C11H14NNaO4S MolecularWeight: 279.28793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+](=CC1=CC=CC=C1S(=O)(=O)[O-])[O-].[Na+]

Isomeric SMILES

CC(C)(C)/[N+](=C\C1=CC=CC=C1S(=O)(=O)[O-])/[O-].[Na+]

InChI

InChI=1S/C11H15NO4S.Na/c1-11(2,3)12(13)8-9-6-4-5-7-10(9)17(14,15)16;/h4-8H,1-3H3,(H,14,15,16);/q;+1/p-1/b12-8+;