methyl 5-[3-fluoranyl-4-(5-methoxy-4,4-dimethyl-5-oxidanylidene-pentoxy)phenoxy]-2,2-dimethyl-pentanoate

Systemtic Name: methyl 5-[3-fluoranyl-4-(5-methoxy-4,4-dimethyl-5-oxidanylidene-pentoxy)phenoxy]-2,2-dimethyl-pentanoate Openeye Name: methyl 5-[3-fluoro-4-(5-methoxy-4,4-dimethyl-5-oxo-pentoxy)phenoxy]-2,2-dimethyl-pentanoate CAS Name: 5-[3-fluoro-4-(5-methoxy-4,4-dimethyl-5-oxopentoxy)phenoxy]-2,2-dimethylpentanoic acid methyl ester IUPAC Name: methyl 5-[3-fluoro-4-(5-methoxy-4,4-dimethyl-5-oxopentoxy)phenoxy]-2,2-dimethylpentanoate Traditional Name: 5-[3-fluoro-4-(5-keto-5-methoxy-4,4-dimethyl-pentoxy)phenoxy]-2,2-dimethyl-valeric acid methyl ester Formula: C22H33FO6 MolecularWeight: 412.492223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCOC1=CC(=C(C=C1)OCCCC(C)(C)C(=O)OC)F)C(=O)OC

Isomeric SMILES

CC(C)(CCCOC1=CC(=C(C=C1)OCCCC(C)(C)C(=O)OC)F)C(=O)OC

InChI

InChI=1S/C22H33FO6/c1-21(2,19(24)26-5)11-7-13-28-16-9-10-18(17(23)15-16)29-14-8-12-22(3,4)20(25)27-6/h9-10,15H,7-8,11-14H2,1-6H3