[3-(1-oxidanylhexyl)phenyl]methyl 4-methylbenzenesulfonate

Systemtic Name: [3-(1-oxidanylhexyl)phenyl]methyl 4-methylbenzenesulfonate Openeye Name: [3-(1-hydroxyhexyl)phenyl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(1-hydroxyhexyl)phenyl]methyl ester IUPAC Name: [3-(1-hydroxyhexyl)phenyl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(1-hydroxyhexyl)benzyl] ester Formula: C20H26O4S MolecularWeight: 362.48304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC(=C1)COS(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

CCCCCC(C1=CC=CC(=C1)COS(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C20H26O4S/c1-3-4-5-9-20(21)18-8-6-7-17(14-18)15-24-25(22,23)19-12-10-16(2)11-13-19/h6-8,10-14,20-21H,3-5,9,15H2,1-2H3