[4-(4-fluorophenyl)carbonylphenyl] (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: [4-(4-fluorobenzoyl)phenyl] (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C24H23FO4 MolecularWeight: 394.435423

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OC4=CC=C(C=C4)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C(=O)OC4=CC=C(C=C4)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H23FO4/c25-19-5-1-17(2-6-19)21(26)18-3-7-20(8-4-18)29-22(27)23-10-15-9-16(11-23)13-24(28,12-15)14-23/h1-8,15-16,28H,9-14H2/t15-,16+,23?,24?