[(E,2S,5R)-4-methyl-2-methylsulfonyl-7-oxidanylidene-5-(2-trimethylsilylethoxy)oct-3-en-3-yl] benzoate

Systemtic Name: [(E,2S,5R)-4-methyl-2-methylsulfonyl-7-oxidanylidene-5-(2-trimethylsilylethoxy)oct-3-en-3-yl] benzoate Openeye Name: [(E,3R)-2-methyl-1-[(1S)-1-methylsulfonylethyl]-5-oxo-3-(2-trimethylsilylethoxy)hex-1-enyl] benzoate CAS Name: benzoic acid [(E,2S,5R)-4-methyl-2-methylsulfonyl-7-oxo-5-(2-trimethylsilylethoxy)oct-3-en-3-yl] ester IUPAC Name: [(E,2S,5R)-4-methyl-2-methylsulfonyl-7-oxo-5-(2-trimethylsilylethoxy)oct-3-en-3-yl] benzoate Traditional Name: benzoic acid [(E,3R)-5-keto-1-[(1S)-1-mesylethyl]-2-methyl-3-(2-trimethylsilylethoxy)hex-1-enyl] ester Formula: C22H34O6SSi MolecularWeight: 454.65226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C(C)C(CC(=O)C)OCC[Si](C)(C)C)OC(=O)C1=CC=CC=C1)S(=O)(=O)C

Isomeric SMILES

C[C@@H](/C(=C(/C)\[C@@H](CC(=O)C)OCC[Si](C)(C)C)/OC(=O)C1=CC=CC=C1)S(=O)(=O)C

InChI

InChI=1S/C22H34O6SSi/c1-16(23)15-20(27-13-14-30(5,6)7)17(2)21(18(3)29(4,25)26)28-22(24)19-11-9-8-10-12-19/h8-12,18,20H,13-15H2,1-7H3/b21-17+/t18-,20+/m0/s1