2-(3,5-dimethylpyridin-1-ium-1-yl)-5,6-dimethyl-4-(4-methylphenyl)sulfonylimino-3-oxidanylidene-cyclohexa-1,5-dien-1-olate

Systemtic Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)-5,6-dimethyl-4-(4-methylphenyl)sulfonylimino-3-oxidanylidene-cyclohexa-1,5-dien-1-olate Openeye Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)-5,6-dimethyl-3-oxo-4-(p-tolylsulfonylimino)cyclohexa-1,5-dien-1-olate CAS Name: 2-(3,5-dimethyl-1-pyridin-1-iumyl)-5,6-dimethyl-4-(4-methylphenyl)sulfonylimino-3-oxo-1-cyclohexa-1,5-dienolate IUPAC Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)-5,6-dimethyl-4-(4-methylphenyl)sulfonylimino-3-oxocyclohexa-1,5-dien-1-olate Traditional Name: 2-(3,5-dimethylpyridin-1-ium-1-yl)-3-keto-5,6-dimethyl-4-tosylimino-cyclohexa-1,5-dien-1-olate Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(C(=C(C2=O)[N+]3=CC(=CC(=C3)C)C)[O-])C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(C(=C(C2=O)[N+]3=CC(=CC(=C3)C)C)[O-])C)C

InChI

InChI=1S/C22H22N2O4S/c1-13-6-8-18(9-7-13)29(27,28)23-19-16(4)17(5)21(25)20(22(19)26)24-11-14(2)10-15(3)12-24/h6-12H,1-5H3