(E)-1-(2,5-dimethylphenyl)sulfonyl-3,3-dimethyl-2-oxidanyl-but-1-ene-1-diazonium

Systemtic Name: (E)-1-(2,5-dimethylphenyl)sulfonyl-3,3-dimethyl-2-oxidanyl-but-1-ene-1-diazonium Openeye Name: (E)-1-(2,5-dimethylphenyl)sulfonyl-2-hydroxy-3,3-dimethyl-but-1-ene-1-diazonium CAS Name: (E)-1-(2,5-dimethylphenyl)sulfonyl-2-hydroxy-3,3-dimethyl-1-butene-1-diazonium IUPAC Name: (E)-1-(2,5-dimethylphenyl)sulfonyl-2-hydroxy-3,3-dimethylbut-1-ene-1-diazonium Traditional Name: (E)-1-(2,5-dimethylphenyl)sulfonyl-2-hydroxy-3,3-dimethyl-but-1-ene-1-diazonium Formula: C14H19N2O3S+ MolecularWeight: 295.37726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)/C(=C(\C(C)(C)C)/O)/[N+]#N

InChI

InChI=1S/C14H18N2O3S/c1-9-6-7-10(2)11(8-9)20(18,19)13(16-15)12(17)14(3,4)5/h6-8H,1-5H3/p+1/b13-12+