methyl 2,2-dimethyl-5-(4-phenoxyphenyl)sulfonyl-1,3-dioxane-5-carboxylate

Systemtic Name: methyl 2,2-dimethyl-5-(4-phenoxyphenyl)sulfonyl-1,3-dioxane-5-carboxylate Openeye Name: methyl 2,2-dimethyl-5-(4-phenoxyphenyl)sulfonyl-1,3-dioxane-5-carboxylate CAS Name: 2,2-dimethyl-5-(4-phenoxyphenyl)sulfonyl-1,3-dioxane-5-carboxylic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-5-(4-phenoxyphenyl)sulfonyl-1,3-dioxane-5-carboxylate Traditional Name: 2,2-dimethyl-5-(4-phenoxyphenyl)sulfonyl-1,3-dioxane-5-carboxylic acid methyl ester Formula: C20H22O7S MolecularWeight: 406.44948

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CC1(OCC(CO1)(C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C20H22O7S/c1-19(2)25-13-20(14-26-19,18(21)24-3)28(22,23)17-11-9-16(10-12-17)27-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3