[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethoxy]-[6-(3-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethoxy]-[6-(3-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethoxy]-[6-(3-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate CAS Name: [2-[4-(methylthio)phenyl]-2-oxoethoxy]-[6-(3-nitrophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]methanolate IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethoxy]-[6-(3-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate Traditional Name: [2-keto-2-[4-(methylthio)phenyl]ethoxy]-[6-(3-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanolate Formula: C22H17N2O7S2- MolecularWeight: 485.50958

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)COC(=C2C=CC=CC2=NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)COC(=C2C=CC=CC2=NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C22H18N2O7S2/c1-32-17-11-9-15(10-12-17)21(25)14-31-22(26)19-7-2-3-8-20(19)23-33(29,30)18-6-4-5-16(13-18)24(27)28/h2-13,26H,14H2,1H3/p-1