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

Systemtic Name: (2-phenoxyphenyl)methyl (5S,7R)-3-chloranyladamantane-1-carboxylate Openeye Name: (2-phenoxyphenyl)methyl (5S,7R)-3-chloroadamantane-1-carboxylate CAS Name: (5S,7R)-3-chloro-1-adamantanecarboxylic acid (2-phenoxyphenyl)methyl ester IUPAC Name: (2-phenoxyphenyl)methyl (5S,7R)-3-chloroadamantane-1-carboxylate Traditional Name: (5S,7R)-3-chloroadamantane-1-carboxylic acid (2-phenoxybenzyl) ester Formula: C24H25ClO3 MolecularWeight: 396.9065

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)OCC4=CC=CC=C4OC5=CC=CC=C5

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Cl)C(=O)OCC4=CC=CC=C4OC5=CC=CC=C5

InChI

InChI=1S/C24H25ClO3/c25-24-13-17-10-18(14-24)12-23(11-17,16-24)22(26)27-15-19-6-4-5-9-21(19)28-20-7-2-1-3-8-20/h1-9,17-18H,10-16H2/t17-,18+,23?,24?