(E)-1-diazonio-4-(1-methylcyclohexa-2,5-dien-1-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-but-1-en-2-olate

Systemtic Name: (E)-1-diazonio-4-(1-methylcyclohexa-2,5-dien-1-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-but-1-en-2-olate Openeye Name: (E)-1-diazonio-4-(1-methylcyclohexa-2,5-dien-1-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-but-1-en-2-olate CAS Name: (E)-1-diazonio-4-(1-methyl-1-cyclohexa-2,5-dienyl)-1-(2,4,6-trimethylphenyl)sulfonyl-1-buten-2-olate IUPAC Name: (E)-1-diazonio-4-(1-methylcyclohexa-2,5-dien-1-yl)-1-(2,4,6-trimethylphenyl)sulfonylbut-1-en-2-olate Traditional Name: (E)-1-diazonio-1-mesitylsulfonyl-4-(1-methylcyclohexa-2,5-dien-1-yl)but-1-en-2-olate Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)C(=C(CCC2(C=CCC=C2)C)[O-])[N+]#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)/C(=C(\CCC2(C=CCC=C2)C)/[O-])/[N+]#N)C

InChI

InChI=1S/C20H24N2O3S/c1-14-12-15(2)18(16(3)13-14)26(24,25)19(22-21)17(23)8-11-20(4)9-6-5-7-10-20/h6-7,9-10,12-13H,5,8,11H2,1-4H3/b19-17+