[(1S)-2-oxaspiro[2.5]octan-1-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(1S)-2-oxaspiro[2.5]octan-1-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(1S)-2-oxaspiro[2.5]octan-1-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S)-2-oxaspiro[2.5]octan-1-yl]methyl ester IUPAC Name: [(1S)-2-oxaspiro[2.5]octan-1-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S)-2-oxaspiro[2.5]octan-1-yl]methyl ester Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C3(O2)CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2C3(O2)CCCCC3

InChI

InChI=1S/C15H20O4S/c1-12-5-7-13(8-6-12)20(16,17)18-11-14-15(19-14)9-3-2-4-10-15/h5-8,14H,2-4,9-11H2,1H3/t14-/m0/s1