1-fluoranylheptyl 4-methylbenzenesulfonate

Systemtic Name: 1-fluoranylheptyl 4-methylbenzenesulfonate Openeye Name: 1-fluoroheptyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-fluoroheptyl ester IUPAC Name: 1-fluoroheptyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-fluoroheptyl ester Formula: C14H21FO3S MolecularWeight: 288.378143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(OS(=O)(=O)C1=CC=C(C=C1)C)F

Isomeric SMILES

CCCCCCC(OS(=O)(=O)C1=CC=C(C=C1)C)F

InChI

InChI=1S/C14H21FO3S/c1-3-4-5-6-7-14(15)18-19(16,17)13-10-8-12(2)9-11-13/h8-11,14H,3-7H2,1-2H3