[(1S,2R)-2-(oxiran-2-ylmethyl)cyclohexyl] 4-methylbenzenesulfonate

Systemtic Name: [(1S,2R)-2-(oxiran-2-ylmethyl)cyclohexyl] 4-methylbenzenesulfonate Openeye Name: [(1S,2R)-2-(oxiran-2-ylmethyl)cyclohexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S,2R)-2-(2-oxiranylmethyl)cyclohexyl] ester IUPAC Name: [(1S,2R)-2-(oxiran-2-ylmethyl)cyclohexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,2R)-2-glycidylcyclohexyl] ester Formula: C16H22O4S MolecularWeight: 310.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2CC3CO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2CCCC[C@@H]2CC3CO3

InChI

InChI=1S/C16H22O4S/c1-12-6-8-15(9-7-12)21(17,18)20-16-5-3-2-4-13(16)10-14-11-19-14/h6-9,13-14,16H,2-5,10-11H2,1H3/t13-,14?,16+/m1/s1