(3-fluoranyl-3-methyl-4-oxidanyl-butyl) benzoate

Systemtic Name: (3-fluoranyl-3-methyl-4-oxidanyl-butyl) benzoate Openeye Name: (3-fluoro-4-hydroxy-3-methyl-butyl) benzoate CAS Name: benzoic acid (3-fluoro-4-hydroxy-3-methylbutyl) ester IUPAC Name: (3-fluoro-4-hydroxy-3-methylbutyl) benzoate Traditional Name: benzoic acid (3-fluoro-4-hydroxy-3-methyl-butyl) ester Formula: C12H15FO3 MolecularWeight: 226.244103

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C1=CC=CC=C1)(CO)F

Isomeric SMILES

CC(CCOC(=O)C1=CC=CC=C1)(CO)F

InChI

InChI=1S/C12H15FO3/c1-12(13,9-14)7-8-16-11(15)10-5-3-2-4-6-10/h2-6,14H,7-9H2,1H3