2-[2,4-bis(chloranyl)phenoxy]ethyl (5S,7R)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]ethyl (5S,7R)-3-oxidanyladamantane-1-carboxylate Openeye Name: 2-(2,4-dichlorophenoxy)ethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate CAS Name: (5S,7R)-3-hydroxy-1-adamantanecarboxylic acid 2-(2,4-dichlorophenoxy)ethyl ester IUPAC Name: 2-(2,4-dichlorophenoxy)ethyl (5S,7R)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5S,7R)-3-hydroxyadamantane-1-carboxylic acid 2-(2,4-dichlorophenoxy)ethyl ester Formula: C19H22Cl2O4 MolecularWeight: 385.28158

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCCOC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H22Cl2O4/c20-14-1-2-16(15(21)6-14)24-3-4-25-17(22)18-7-12-5-13(8-18)10-19(23,9-12)11-18/h1-2,6,12-13,23H,3-5,7-11H2/t12-,13+,18?,19?