1-adamantyl 2-bromanylbenzoate

Systemtic Name: 1-adamantyl 2-bromanylbenzoate Openeye Name: 1-adamantyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid 1-adamantyl ester IUPAC Name: 1-adamantyl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid 1-adamantyl ester Formula: C17H19BrO2 MolecularWeight: 335.23556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OC(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C17H19BrO2/c18-15-4-2-1-3-14(15)16(19)20-17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2