(4-phenoxyphenyl) (5S,7R)-3-chloranyladamantane-1-carboxylate

Systemtic Name: (4-phenoxyphenyl) (5S,7R)-3-chloranyladamantane-1-carboxylate Openeye Name: (4-phenoxyphenyl) (5S,7R)-3-chloroadamantane-1-carboxylate CAS Name: (5S,7R)-3-chloro-1-adamantanecarboxylic acid (4-phenoxyphenyl) ester IUPAC Name: (4-phenoxyphenyl) (5S,7R)-3-chloroadamantane-1-carboxylate Traditional Name: (5S,7R)-3-chloroadamantane-1-carboxylic acid (4-phenoxyphenyl) ester Formula: C23H23ClO3 MolecularWeight: 382.87992

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)OC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Cl)C(=O)OC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C23H23ClO3/c24-23-13-16-10-17(14-23)12-22(11-16,15-23)21(25)27-20-8-6-19(7-9-20)26-18-4-2-1-3-5-18/h1-9,16-17H,10-15H2/t16-,17+,22?,23?