3-[(5R,10R)-10-oxidanyl-4-oxaspiro[4.5]decan-10-yl]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[(5R,10R)-10-oxidanyl-4-oxaspiro[4.5]decan-10-yl]propyl 4-methylbenzenesulfonate Openeye Name: 3-[(5R,10R)-10-hydroxy-4-oxaspiro[4.5]decan-10-yl]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[(5R,10R)-10-hydroxy-4-oxaspiro[4.5]decan-10-yl]propyl ester IUPAC Name: 3-[(5R,10R)-10-hydroxy-4-oxaspiro[4.5]decan-10-yl]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-[(5R,10R)-10-hydroxy-4-oxaspiro[4.5]decan-10-yl]propyl ester Formula: C19H28O5S MolecularWeight: 368.48762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2(CCCCC23CCCO3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC[C@@]2(CCCC[C@@]23CCCO3)O

InChI

InChI=1S/C19H28O5S/c1-16-6-8-17(9-7-16)25(21,22)24-15-4-11-18(20)10-2-3-12-19(18)13-5-14-23-19/h6-9,20H,2-5,10-15H2,1H3/t18-,19-/m1/s1