2-fluoranylnonyl 4-methylbenzenesulfonate

Systemtic Name: 2-fluoranylnonyl 4-methylbenzenesulfonate Openeye Name: 2-fluorononyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-fluorononyl ester IUPAC Name: 2-fluorononyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-fluorononyl ester Formula: C16H25FO3S MolecularWeight: 316.431303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(COS(=O)(=O)C1=CC=C(C=C1)C)F

Isomeric SMILES

CCCCCCCC(COS(=O)(=O)C1=CC=C(C=C1)C)F

InChI

InChI=1S/C16H25FO3S/c1-3-4-5-6-7-8-15(17)13-20-21(18,19)16-11-9-14(2)10-12-16/h9-12,15H,3-8,13H2,1-2H3