(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 4-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 4-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 4-(4-fluorophenyl)-4-oxo-butanoate CAS Name: 4-(4-fluorophenyl)-4-oxobutanoic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 4-(4-fluorophenyl)-4-oxobutanoate Traditional Name: 4-(4-fluorophenyl)-4-keto-butyric acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C22H23FO4 MolecularWeight: 370.414023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)CCC(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)CCC(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C22H23FO4/c1-13-11-14(2)22(16(4)24)15(3)19(13)12-27-21(26)10-9-20(25)17-5-7-18(23)8-6-17/h5-8,11H,9-10,12H2,1-4H3