methyl 2-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxidanylidene-furan-3-yl]oxypropanoate

Systemtic Name: methyl 2-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxidanylidene-furan-3-yl]oxypropanoate Openeye Name: methyl 2-[[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxo-3-furyl]oxy]propanoate CAS Name: 2-[[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxo-3-furanyl]oxy]propanoic acid methyl ester IUPAC Name: methyl 2-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxofuran-3-yl]oxypropanoate Traditional Name: 2-[[2-keto-4-(4-mesylphenyl)-5,5-dimethyl-3-furyl]oxy]propionic acid methyl ester Formula: C17H20O7S MolecularWeight: 368.4015

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=C(C(OC1=O)(C)C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)OC)OC1=C(C(OC1=O)(C)C)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H20O7S/c1-10(15(18)22-4)23-14-13(17(2,3)24-16(14)19)11-6-8-12(9-7-11)25(5,20)21/h6-10H,1-5H3