potassium 4-[(Z)-4-diazonio-3-oxidanidyl-5-oxidanylidene-hex-3-enyl]benzenesulfonate

Systemtic Name: potassium 4-[(Z)-4-diazonio-3-oxidanidyl-5-oxidanylidene-hex-3-enyl]benzenesulfonate Openeye Name: potassium 4-[(Z)-4-diazonio-3-oxido-5-oxo-hex-3-enyl]benzenesulfonate CAS Name: potassium 4-[(Z)-4-diazonio-3-oxido-5-oxohex-3-enyl]benzenesulfonate IUPAC Name: potassium 4-[(Z)-4-diazonio-3-oxido-5-oxohex-3-enyl]benzenesulfonate Traditional Name: potassium 4-[(Z)-4-diazonio-5-keto-3-oxido-hex-3-enyl]besylate Formula: C12H11KN2O5S MolecularWeight: 334.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(CCC1=CC=C(C=C1)S(=O)(=O)[O-])[O-])[N+]#N.[K+]

Isomeric SMILES

CC(=O)/C(=C(\CCC1=CC=C(C=C1)S(=O)(=O)[O-])/[O-])/[N+]#N.[K+]

InChI

InChI=1S/C12H12N2O5S.K/c1-8(15)12(14-13)11(16)7-4-9-2-5-10(6-3-9)20(17,18)19;/h2-3,5-6H,4,7H2,1H3,(H-,15,16,17,18,19);/q;+1/p-1