[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 3-bromanyladamantane-1-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 3-bromanyladamantane-1-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 3-bromoadamantane-1-carboxylate CAS Name: 3-bromo-1-adamantanecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 3-bromoadamantane-1-carboxylate Traditional Name: 3-bromoadamantane-1-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C21H24BrFO3 MolecularWeight: 423.315863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrFO3/c22-21-11-14-8-15(12-21)10-20(9-14,13-21)19(25)26-7-1-2-18(24)16-3-5-17(23)6-4-16/h3-6,14-15H,1-2,7-13H2