[2,6-bis(chloranyl)phenyl]methyl (5S,7R)-3-bromanyladamantane-1-carboxylate

Systemtic Name: [2,6-bis(chloranyl)phenyl]methyl (5S,7R)-3-bromanyladamantane-1-carboxylate Openeye Name: (2,6-dichlorophenyl)methyl (5S,7R)-3-bromoadamantane-1-carboxylate CAS Name: (5S,7R)-3-bromo-1-adamantanecarboxylic acid (2,6-dichlorophenyl)methyl ester IUPAC Name: (2,6-dichlorophenyl)methyl (5S,7R)-3-bromoadamantane-1-carboxylate Traditional Name: (5S,7R)-3-bromoadamantane-1-carboxylic acid (2,6-dichlorobenzyl) ester Formula: C18H19BrCl2O2 MolecularWeight: 418.15226

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)C(=O)OCC4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Br)C(=O)OCC4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C18H19BrCl2O2/c19-18-7-11-4-12(8-18)6-17(5-11,10-18)16(22)23-9-13-14(20)2-1-3-15(13)21/h1-3,11-12H,4-10H2/t11-,12+,17?,18?