2-methylbutan-2-yl (1S)-1-phenylethanesulfinate

Systemtic Name: 2-methylbutan-2-yl (1S)-1-phenylethanesulfinate Openeye Name: 1,1-dimethylpropyl (1S)-1-phenylethanesulfinate CAS Name: (1S)-1-phenylethanesulfinic acid 2-methylbutan-2-yl ester IUPAC Name: 2-methylbutan-2-yl (1S)-1-phenylethanesulfinate Traditional Name: (1S)-1-phenylethanesulfinic acid tert-amyl ester Formula: C13H20O2S MolecularWeight: 240.3617

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OS(=O)C(C)C1=CC=CC=C1

Isomeric SMILES

CCC(C)(C)OS(=O)[C@@H](C)C1=CC=CC=C1

InChI

InChI=1S/C13H20O2S/c1-5-13(3,4)15-16(14)11(2)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3/t11-,16?/m0/s1