[(2S,3R)-3-butyloxiran-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(2S,3R)-3-butyloxiran-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2S,3R)-3-butyloxiran-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3R)-3-butyl-2-oxiranyl]methyl ester IUPAC Name: [(2S,3R)-3-butyloxiran-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,3R)-3-butyloxiran-2-yl]methyl ester Formula: C14H20O4S MolecularWeight: 284.3712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(O1)COS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC[C@@H]1[C@@H](O1)COS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H20O4S/c1-3-4-5-13-14(18-13)10-17-19(15,16)12-8-6-11(2)7-9-12/h6-9,13-14H,3-5,10H2,1-2H3/t13-,14+/m1/s1