(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 3-chloranyladamantane-1-carboxylate

Systemtic Name: (7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 3-chloranyladamantane-1-carboxylate Openeye Name: (7-fluoro-1-methyl-3-oxo-indan-4-yl) 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid (7-fluoro-3-keto-1-methyl-indan-4-yl) ester Formula: C21H22ClFO3 MolecularWeight: 376.848983

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C21H22ClFO3/c1-11-4-15(24)18-16(3-2-14(23)17(11)18)26-19(25)20-6-12-5-13(7-20)9-21(22,8-12)10-20/h2-3,11-13H,4-10H2,1H3