[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [2-(3,4-difluorophenyl)-2-oxo-ethyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [2-(3,4-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluorophenyl)-2-oxoethyl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [2-(3,4-difluorophenyl)-2-keto-ethyl] ester Formula: C19H20F2O4 MolecularWeight: 350.356506

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C19H20F2O4/c20-14-2-1-13(4-15(14)21)16(22)9-25-17(23)18-5-11-3-12(6-18)8-19(24,7-11)10-18/h1-2,4,11-12,24H,3,5-10H2