octan-2-yl 3-fluoranyl-4-oxidanyl-benzoate

Systemtic Name: octan-2-yl 3-fluoranyl-4-oxidanyl-benzoate Openeye Name: 1-methylheptyl 3-fluoro-4-hydroxy-benzoate CAS Name: 3-fluoro-4-hydroxybenzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 3-fluoro-4-hydroxybenzoate Traditional Name: 3-fluoro-4-hydroxy-benzoic acid 1-methylheptyl ester Formula: C15H21FO3 MolecularWeight: 268.323843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21FO3/c1-3-4-5-6-7-11(2)19-15(18)12-8-9-14(17)13(16)10-12/h8-11,17H,3-7H2,1-2H3