[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-(2-chloro-6-fluoro-phenyl)acetate CAS Name: 2-(2-chloro-6-fluorophenyl)acetic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate Traditional Name: 2-(2-chloro-6-fluoro-phenyl)acetic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C20H22ClFO3 MolecularWeight: 364.838283

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C20H22ClFO3/c21-16-2-1-3-17(22)15(16)7-19(24)25-11-18(23)20-8-12-4-13(9-20)6-14(5-12)10-20/h1-3,12-14H,4-11H2