methyl 7-(5-ethanoyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)-7-oxidanyl-heptanoate

Systemtic Name: methyl 7-(5-ethanoyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)-7-oxidanyl-heptanoate Openeye Name: methyl 7-(5-acetyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)-7-hydroxy-heptanoate CAS Name: 7-(5-acetyl-2-methoxy-3,4,6-trimethylphenyl)-7-(4-fluorophenyl)-7-hydroxyheptanoic acid methyl ester IUPAC Name: methyl 7-(5-acetyl-2-methoxy-3,4,6-trimethylphenyl)-7-(4-fluorophenyl)-7-hydroxyheptanoate Traditional Name: 7-(5-acetyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)-7-hydroxy-enanthic acid methyl ester Formula: C26H33FO5 MolecularWeight: 444.535623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)OC)C(CCCCCC(=O)OC)(C2=CC=C(C=C2)F)O)C)C(=O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)OC)C(CCCCCC(=O)OC)(C2=CC=C(C=C2)F)O)C)C(=O)C

InChI

InChI=1S/C26H33FO5/c1-16-17(2)25(32-6)24(18(3)23(16)19(4)28)26(30,20-11-13-21(27)14-12-20)15-9-7-8-10-22(29)31-5/h11-14,30H,7-10,15H2,1-6H3