[(4S,5S)-5-chloranyl-3,3,6,6-tetramethyl-thiepan-4-yl] ethanoate

Systemtic Name: [(4S,5S)-5-chloranyl-3,3,6,6-tetramethyl-thiepan-4-yl] ethanoate Openeye Name: [(4S,5S)-5-chloro-3,3,6,6-tetramethyl-thiepan-4-yl] acetate CAS Name: acetic acid [(4S,5S)-5-chloro-3,3,6,6-tetramethyl-4-thiepanyl] ester IUPAC Name: [(4S,5S)-5-chloro-3,3,6,6-tetramethylthiepan-4-yl] acetate Traditional Name: acetic acid [(4S,5S)-5-chloro-3,3,6,6-tetramethyl-thiepan-4-yl] ester Formula: C12H21ClO2S MolecularWeight: 264.81194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(CSCC1(C)C)(C)C)Cl

Isomeric SMILES

CC(=O)O[C@@H]1[C@H](C(CSCC1(C)C)(C)C)Cl

InChI

InChI=1S/C12H21ClO2S/c1-8(14)15-10-9(13)11(2,3)6-16-7-12(10,4)5/h9-10H,6-7H2,1-5H3/t9-,10-/m1/s1