sodium 4-(4-chlorophenyl)-2-methyl-3-(4-methylsulfonylphenyl)-5-oxidanylidene-furan-2-olate

Systemtic Name: sodium 4-(4-chlorophenyl)-2-methyl-3-(4-methylsulfonylphenyl)-5-oxidanylidene-furan-2-olate Openeye Name: sodium 4-(4-chlorophenyl)-2-methyl-3-(4-methylsulfonylphenyl)-5-oxo-furan-2-olate CAS Name: sodium 4-(4-chlorophenyl)-2-methyl-3-(4-methylsulfonylphenyl)-5-oxo-2-furanolate IUPAC Name: sodium 4-(4-chlorophenyl)-2-methyl-3-(4-methylsulfonylphenyl)-5-oxofuran-2-olate Traditional Name: sodium 4-(4-chlorophenyl)-5-keto-3-(4-mesylphenyl)-2-methyl-furan-2-olate Formula: C18H14ClNaO5S MolecularWeight: 400.80853

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)C)[O-].[Na+]

Isomeric SMILES

CC1(C(=C(C(=O)O1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)C)[O-].[Na+]

InChI

InChI=1S/C18H14ClO5S.Na/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11;/h3-10H,1-2H3;/q-1;+1