4-oxidanylpentyl 4-methylbenzenesulfonate

Systemtic Name: 4-oxidanylpentyl 4-methylbenzenesulfonate Openeye Name: 4-hydroxypentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-hydroxypentyl ester IUPAC Name: 4-hydroxypentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-hydroxypentyl ester Formula: C12H18O4S MolecularWeight: 258.33392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O4S/c1-10-5-7-12(8-6-10)17(14,15)16-9-3-4-11(2)13/h5-8,11,13H,3-4,9H2,1-2H3