tert-butyl 4-[3-methyl-3-[4-(3-methylsulfonyloxypropyl)phenoxy]-2-oxidanylidene-butoxy]benzoate

Systemtic Name: tert-butyl 4-[3-methyl-3-[4-(3-methylsulfonyloxypropyl)phenoxy]-2-oxidanylidene-butoxy]benzoate Openeye Name: tert-butyl 4-[3-methyl-3-[4-(3-methylsulfonyloxypropyl)phenoxy]-2-oxo-butoxy]benzoate CAS Name: 4-[3-methyl-3-[4-(3-methylsulfonyloxypropyl)phenoxy]-2-oxobutoxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-methyl-3-[4-(3-methylsulfonyloxypropyl)phenoxy]-2-oxobutoxy]benzoate Traditional Name: 4-[2-keto-3-methyl-3-[4-(3-methylsulfonyloxypropyl)phenoxy]butoxy]benzoic acid tert-butyl ester Formula: C26H34O8S MolecularWeight: 506.60836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)OCC(=O)C(C)(C)OC2=CC=C(C=C2)CCCOS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)OCC(=O)C(C)(C)OC2=CC=C(C=C2)CCCOS(=O)(=O)C

InChI

InChI=1S/C26H34O8S/c1-25(2,3)34-24(28)20-11-15-21(16-12-20)31-18-23(27)26(4,5)33-22-13-9-19(10-14-22)8-7-17-32-35(6,29)30/h9-16H,7-8,17-18H2,1-6H3