O-[(1R,2R)-2-oxidanylcyclohexyl] benzenecarbothioate

Systemtic Name: O-[(1R,2R)-2-oxidanylcyclohexyl] benzenecarbothioate Openeye Name: O-[(1R,2R)-2-hydroxycyclohexyl] benzenecarbothioate CAS Name: benzenecarbothioic acid O-[(1R,2R)-2-hydroxycyclohexyl] ester IUPAC Name: O-[(1R,2R)-2-hydroxycyclohexyl] benzenecarbothioate Traditional Name: thiobenzoic acid O-[(1R,2R)-2-hydroxycyclohexyl] ester Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)O)OC(=S)C2=CC=CC=C2

Isomeric SMILES

C1CC[C@H]([C@@H](C1)O)OC(=S)C2=CC=CC=C2

InChI

InChI=1S/C13H16O2S/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-3,6-7,11-12,14H,4-5,8-9H2/t11-,12-/m1/s1