pentyl 2-fluoranyl-4-methyl-3-oxidanyl-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: pentyl 2-fluoranyl-4-methyl-3-oxidanyl-cyclohexa-1,3-diene-1-carboxylate Openeye Name: pentyl 2-fluoro-3-hydroxy-4-methyl-cyclohexa-1,3-diene-1-carboxylate CAS Name: 2-fluoro-3-hydroxy-4-methyl-1-cyclohexa-1,3-dienecarboxylic acid pentyl ester IUPAC Name: pentyl 2-fluoro-3-hydroxy-4-methylcyclohexa-1,3-diene-1-carboxylate Traditional Name: 2-fluoro-3-hydroxy-4-methyl-cyclohexa-1,3-diene-1-carboxylic acid amyl ester Formula: C13H19FO3 MolecularWeight: 242.286563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C(=C(CC1)C)O)F

Isomeric SMILES

CCCCCOC(=O)C1=C(C(=C(CC1)C)O)F

InChI

InChI=1S/C13H19FO3/c1-3-4-5-8-17-13(16)10-7-6-9(2)12(15)11(10)14/h15H,3-8H2,1-2H3