(E)-1-(2-butoxy-5-methyl-phenyl)sulfonyl-1-diazonio-3,3-dimethyl-but-1-en-2-olate

Systemtic Name: (E)-1-(2-butoxy-5-methyl-phenyl)sulfonyl-1-diazonio-3,3-dimethyl-but-1-en-2-olate Openeye Name: (E)-1-(2-butoxy-5-methyl-phenyl)sulfonyl-1-diazonio-3,3-dimethyl-but-1-en-2-olate CAS Name: (E)-1-(2-butoxy-5-methylphenyl)sulfonyl-1-diazonio-3,3-dimethyl-1-buten-2-olate IUPAC Name: (E)-1-(2-butoxy-5-methylphenyl)sulfonyl-1-diazonio-3,3-dimethylbut-1-en-2-olate Traditional Name: (E)-1-(2-butoxy-5-methyl-phenyl)sulfonyl-1-diazonio-3,3-dimethyl-but-1-en-2-olate Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C)S(=O)(=O)C(=C(C(C)(C)C)[O-])[N+]#N

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C)S(=O)(=O)/C(=C(\C(C)(C)C)/[O-])/[N+]#N

InChI

InChI=1S/C17H24N2O4S/c1-6-7-10-23-13-9-8-12(2)11-14(13)24(21,22)16(19-18)15(20)17(3,4)5/h8-9,11H,6-7,10H2,1-5H3/b16-15+