2-oxidanylheptyl 4-methylbenzenesulfonate

Systemtic Name: 2-oxidanylheptyl 4-methylbenzenesulfonate Openeye Name: 2-hydroxyheptyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-hydroxyheptyl ester IUPAC Name: 2-hydroxyheptyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-hydroxyheptyl ester Formula: C14H22O4S MolecularWeight: 286.38708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O4S/c1-3-4-5-6-13(15)11-18-19(16,17)14-9-7-12(2)8-10-14/h7-10,13,15H,3-6,11H2,1-2H3