(5-fluoranyl-6-oxidanyl-nonan-3-yl) benzoate

Systemtic Name: (5-fluoranyl-6-oxidanyl-nonan-3-yl) benzoate Openeye Name: (1-ethyl-3-fluoro-4-hydroxy-heptyl) benzoate CAS Name: benzoic acid (5-fluoro-6-hydroxynonan-3-yl) ester IUPAC Name: (5-fluoro-6-hydroxynonan-3-yl) benzoate Traditional Name: benzoic acid (1-ethyl-3-fluoro-4-hydroxy-heptyl) ester Formula: C16H23FO3 MolecularWeight: 282.350423

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(CC)OC(=O)C1=CC=CC=C1)F)O

Isomeric SMILES

CCCC(C(CC(CC)OC(=O)C1=CC=CC=C1)F)O

InChI

InChI=1S/C16H23FO3/c1-3-8-15(18)14(17)11-13(4-2)20-16(19)12-9-6-5-7-10-12/h5-7,9-10,13-15,18H,3-4,8,11H2,1-2H3