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

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C19H20ClFO3 MolecularWeight: 350.811703

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C19H20ClFO3/c20-14-2-1-3-15(21)17(14)18(23)24-10-16(22)19-7-11-4-12(8-19)6-13(5-11)9-19/h1-3,11-13H,4-10H2