tert-butyl (1S,5S)-5-[tert-butyl(dimethyl)silyl]oxy-2-oxidanylidene-1-(phenylmethyl)cycloheptane-1-carboxylate

Systemtic Name: tert-butyl (1S,5S)-5-[tert-butyl(dimethyl)silyl]oxy-2-oxidanylidene-1-(phenylmethyl)cycloheptane-1-carboxylate Openeye Name: tert-butyl (1S,5S)-1-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-2-oxo-cycloheptanecarboxylate CAS Name: (1S,5S)-5-[tert-butyl(dimethyl)silyl]oxy-2-oxo-1-(phenylmethyl)-1-cycloheptanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,5S)-1-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-2-oxocycloheptane-1-carboxylate Traditional Name: (1S,5S)-1-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-2-keto-cycloheptanecarboxylic acid tert-butyl ester Formula: C25H40O4Si MolecularWeight: 432.6682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCC(CCC1=O)O[Si](C)(C)C(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@@]1(CC[C@@H](CCC1=O)O[Si](C)(C)C(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C25H40O4Si/c1-23(2,3)28-22(27)25(18-19-12-10-9-11-13-19)17-16-20(14-15-21(25)26)29-30(7,8)24(4,5)6/h9-13,20H,14-18H2,1-8H3/t20-,25+/m1/s1