benzenediazonium; 4-methylbenzenesulfonate

Systemtic Name: benzenediazonium; 4-methylbenzenesulfonate Openeye Name: benzenediazonium; 4-methylbenzenesulfonate CAS Name: benzenediazonium; 4-methylbenzenesulfonate IUPAC Name: benzenediazonium; 4-methylbenzenesulfonate Traditional Name: benzenediazonium tosylate Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)[N+]#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)[N+]#N

InChI

InChI=1S/C7H8O3S.C6H5N2/c1-6-2-4-7(5-3-6)11(8,9)10;7-8-6-4-2-1-3-5-6/h2-5H,1H3,(H,8,9,10);1-5H/q;+1/p-1