2-(3-bromanylphenoxy)ethyl (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: 2-(3-bromophenoxy)ethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid 2-(3-bromophenoxy)ethyl ester Formula: C19H23BrO4 MolecularWeight: 395.28752

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C(=O)OCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C19H23BrO4/c20-15-2-1-3-16(7-15)23-4-5-24-17(21)18-8-13-6-14(9-18)11-19(22,10-13)12-18/h1-3,7,13-14,22H,4-6,8-12H2/t13-,14+,18?,19?