ethyl 5-ethyl-3-fluoranyl-2-(2-methoxyphenyl)-6-oxidanyl-4-propyl-benzoate

Systemtic Name: ethyl 5-ethyl-3-fluoranyl-2-(2-methoxyphenyl)-6-oxidanyl-4-propyl-benzoate Openeye Name: ethyl 3-ethyl-5-fluoro-2-hydroxy-6-(2-methoxyphenyl)-4-propyl-benzoate CAS Name: 3-ethyl-5-fluoro-2-hydroxy-6-(2-methoxyphenyl)-4-propylbenzoic acid ethyl ester IUPAC Name: ethyl 3-ethyl-5-fluoro-2-hydroxy-6-(2-methoxyphenyl)-4-propylbenzoate Traditional Name: 3-ethyl-5-fluoro-2-hydroxy-6-(2-methoxyphenyl)-4-propyl-benzoic acid ethyl ester Formula: C21H25FO4 MolecularWeight: 360.419203

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C(=C1CC)O)C(=O)OCC)C2=CC=CC=C2OC)F

Isomeric SMILES

CCCC1=C(C(=C(C(=C1CC)O)C(=O)OCC)C2=CC=CC=C2OC)F

InChI

InChI=1S/C21H25FO4/c1-5-10-14-13(6-2)20(23)18(21(24)26-7-3)17(19(14)22)15-11-8-9-12-16(15)25-4/h8-9,11-12,23H,5-7,10H2,1-4H3