4-methylbenzenediazonium; 2,4,6-trimethylbenzenesulfonate

Systemtic Name: 4-methylbenzenediazonium; 2,4,6-trimethylbenzenesulfonate Openeye Name: 4-methylbenzenediazonium; 2,4,6-trimethylbenzenesulfonate CAS Name: 4-methylbenzenediazonium; 2,4,6-trimethylbenzenesulfonate IUPAC Name: 4-methylbenzenediazonium; 2,4,6-trimethylbenzenesulfonate Traditional Name: 4-methylbenzenediazonium; 2,4,6-trimethylbesylate Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O3S.C7H7N2/c1-6-4-7(2)9(8(3)5-6)13(10,11)12;1-6-2-4-7(9-8)5-3-6/h4-5H,1-3H3,(H,10,11,12);2-5H,1H3/q;+1/p-1