naphthalen-2-yl (5S,7R)-3-bromanyladamantane-1-carboxylate

Systemtic Name: naphthalen-2-yl (5S,7R)-3-bromanyladamantane-1-carboxylate Openeye Name: 2-naphthyl (5S,7R)-3-bromoadamantane-1-carboxylate CAS Name: (5S,7R)-3-bromo-1-adamantanecarboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl (5S,7R)-3-bromoadamantane-1-carboxylate Traditional Name: (5S,7R)-3-bromoadamantane-1-carboxylic acid 2-naphthyl ester Formula: C21H21BrO2 MolecularWeight: 385.29424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)C(=O)OC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Br)C(=O)OC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C21H21BrO2/c22-21-11-14-7-15(12-21)10-20(9-14,13-21)19(23)24-18-6-5-16-3-1-2-4-17(16)8-18/h1-6,8,14-15H,7,9-13H2/t14-,15+,20?,21?