methyl 1,1-bis(oxidanylidene)-4-(4-phenoxyphenyl)sulfonyl-thiane-4-carboxylate

Systemtic Name: methyl 1,1-bis(oxidanylidene)-4-(4-phenoxyphenyl)sulfonyl-thiane-4-carboxylate Openeye Name: methyl 1,1-dioxo-4-(4-phenoxyphenyl)sulfonyl-thiane-4-carboxylate CAS Name: 1,1-dioxo-4-(4-phenoxyphenyl)sulfonyl-4-thianecarboxylic acid methyl ester IUPAC Name: methyl 1,1-dioxo-4-(4-phenoxyphenyl)sulfonylthiane-4-carboxylate Traditional Name: 1,1-diketo-4-(4-phenoxyphenyl)sulfonyl-thiane-4-carboxylic acid methyl ester Formula: C19H20O7S2 MolecularWeight: 424.4879

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCS(=O)(=O)CC1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCS(=O)(=O)CC1)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H20O7S2/c1-25-18(20)19(11-13-27(21,22)14-12-19)28(23,24)17-9-7-16(8-10-17)26-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3